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2-(methoxycarbonyl)phenyl 4-(4-bromophenyl)-1-chloro-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylate

Catalog ID
STK550734
SMILES COC(=O)c1ccccc1OC(=O)c1ccc2c(c1)C1C(Cl)C(CC1C(N2)c1ccc(cc1)Br)Sc1ccccc1[N+](=O)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C33H26BrClN2O6S MW 694.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H26BrClN2O6S/c1-42-33(39)21-6-2-4-8-26(21)43-32(38)19-12-15-24-22(16-19)29-23(31(36-24)18-10-13-20(34)14-11-18)17-28(30(29)35)44-27-9-5-3-7-25(27)37(40)41/h2-16,23,28-31,36H,17H2,1H3
InChIKey
ITEUNMLJIJCQRD-UHFFFAOYSA-N
Synonyms

(2METHOXYCARBONYLPHENYL)4(4BROMOPHENYL)1CHLORO2(2NITROPHENYL)SULFANYL233A459BHEXAHYDRO1HCYCLOPENTA(C)QUINOLINE8CARBOXYLATE
2(methoxycarbonyl)phenyl4(4bromophenyl)1chloro2((2nitrophenyl)sulfanyl)233a459bhexahydro1Hcyclopenta(c)quinoline8carboxylate
2(methoxycarbonyl)phenyl4(4bromophenyl)1chloro2((2nitrophenyl)thio)233a459bhexahydro1Hcyclopenta(c)quinoline8carboxylate
COC(=O)C1=CC=CC=C1OC(=O)C2=CC3=C(C=C2)NC(C4C3C(C(C4)SC5=CC=CC=C5(N+)(=O)(O))Cl)C6=CC=C(C=C6)Br
COC(=O)c1ccccc1OC(=O)c1ccc2c(c1)C1C(Cl)C(CC1C(N2)c1ccc(cc1)Br)Sc1ccccc1(N+)(=O)(O)
InChI=1SC33H26BrClN2O6Sc14233(39)21624826(21)4332(38)1912152422(1619)2923(31(3624)18101320(34)141118)1728(30(29)35)4427953725(27)37(40)41h21623283136H17H21H3
MFCD03675913
ZINC000150646386
ZINC000229863725

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Available files

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