Vitas-M small molecule compound
4-[(3aS,4R,9bR)-6,9-dichloro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]benzoic acid
Catalog ID
STL280634
SMILES Clc1ccc(c2c1N[C@@H](c1ccc(cc1)C(=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 C19H15Cl2NO2 MW 360.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15Cl2NO2/c20-14-8-9-15(21)18-16(14)12-2-1-3-13(12)17(22-18)10-4-6-11(7-5-10)19(23)24/h1-2,4-9,12-13,17,22H,3H2,(H,23,24)/t12-,13+,17+/m1/s1InChIKey
KBWDYBOXSLHMSD-IGCXYCKISA-NSynonyms
4((3aS4R9bR)69dichloro3a459btetrahydro3Hcyclopenta(c)quinolin4yl)benzoicacid
C1C=CC2C1C(NC3=C(C=CC(=C23)Cl)Cl)C4=CC=C(C=C4)C(=O)O
Clc1ccc(c2c1N(C@@H)(c1ccc(cc1)C(=O)O)(C@@H)1(C@H)2C=CC1)Cl
InChI=1SC19H15Cl2NO2c20148915(21)1816(14)1221313(12)17(2218)104611(7510)19(23)24h124912131722H3H2(H2324)t1213+17+m1s1
MFCD09992434
ZINC000004501458
ZINC4501458
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