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Roxatidine Impurity 1

Roxatidine Impurity 1

Product Description
CAT No.
ALN-R040003
CAS No.
876497-65-3
Mol. F.
C7H6N2O2
Mol. Wt.
150.1
Stock
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Chemical Name : N-(3-formylphenyl)nitrous amide
Smiles : O=NNC1=CC(C=O)=CC=C1
Inchi : InChI=1S/C141H218O94S15/c142-63(143)1-16-236-32-48-111-80(173)96(189)128(206-48)223-113-50(34-238-18-3-65(146)147)208-130(98(191)82(113)175)225-115-52(36-240-20-5-67(150)151)210-132(100(193)84(115)177)227-117-54(38-242-22-7-69(154)155)211-133(101(194)85(117)178)226-116-53(37-241-21-6-68(152)153)209-131(99(192)83(116)176)224-114-51(35-239-19-4-66(148)149)207-129(97(190)81(114)174)222-112-49(33-237-17-2-64(144)145)205-127(95(188)79(112)172)220-110-47(204-126(221-111)94(187)78(110)171)31-203-77(170)15-30-250-46-62-125-93(186)109(202)141(219-62)234-124-61(45-249-29-14-76(168)169)217-139(107(200)91(124)184)232-122-59(43-247-27-12-74(164)165)215-137(105(198)89(122)182)230-120-57(41-245-25-10-72(160)161)213-135(103(196)87(120)180)228-118-55(39-243-23-8-70(156)157)212-134(102(195)86(118)179)229-119-56(40-244-24-9-71(158)159)214-136(104(197)88(119)181)231-121-58(42-246-26-11-73(162)163)216-138(106(199)90(121)183)233-123-60(44-248-28-13-75(166)167)218-140(235-125)108(201)92(123)185/h47-62,78-141,171-202H,1-46H2,(H,142,143)(H,144,145)(H,146,147)(H,148,149)(H,150,151)(H,152,153)(H,154,155)(H,156,157)(H,158,159)(H,160,161)(H,162,163)(H,164,165)(H,166,167)(H,168,169)/t47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-/m1/s1

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