Vitas-M small molecule compound

(3aS,4R,9bR)-6,8,9-trichloro-4-(4-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline

Catalog ID
STL222083
SMILES Clc1cc(Cl)c(c2c1N[C@@H](c1ccc(cc1)[N+](=O)[O-])[C@@H]1[C@H]2C=CC1)Cl

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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 C18H13Cl3N2O2 MW 395.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13Cl3N2O2/c19-13-8-14(20)18-15(16(13)21)11-2-1-3-12(11)17(22-18)9-4-6-10(7-5-9)23(24)25/h1-2,4-8,11-12,17,22H,3H2/t11-,12+,17+/m1/s1
InChIKey
KICUXGFMZIKVEK-PEBVRCNWSA-N
Synonyms

(3aS4R9bR)689trichloro4(4nitrophenyl)3a459btetrahydro3Hcyclopenta(c)quinoline
C1C=CC2C1C(NC3=C2C(=C(C=C3Cl)Cl)Cl)C4=CC=C(C=C4)(N+)(=O)(O)
Clc1cc(Cl)c(c2c1N(C@@H)(c1ccc(cc1)(N+)(=O)(O))(C@@H)1(C@H)2C=CC1)Cl
InChI=1SC18H13Cl3N2O2c1913814(20)1815(16(13)21)1121312(11)17(2218)94610(759)23(24)25h124811121722H3H2t1112+17+m1s1
MFCD24857624
ZINC000005945063
ZINC05945063
ZINC5945063

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Available files

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