Vitas-M small molecule compound
2-(methoxycarbonyl)phenyl 4-(4-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate
Catalog ID
STK550661
SMILES COC(=O)c1ccccc1OC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1)[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 C27H22N2O6 MW 470.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O6/c1-34-27(31)21-5-2-3-8-24(21)35-26(30)17-11-14-23-22(15-17)19-6-4-7-20(19)25(28-23)16-9-12-18(13-10-16)29(32)33/h2-6,8-15,19-20,25,28H,7H2,1H3InChIKey
UWRQOBHLDFNQBV-UHFFFAOYSA-NSynonyms
1023849-17-3(2METHOXYCARBONYLPHENYL)4(4NITROPHENYL)3A459BTETRAHYDRO3HCYCLOPENTA(C)QUINOLINE8CARBOXYLATE
1023849173
2(methoxycarbonyl)phenyl4(4nitrophenyl)3a459btetrahydro3Hcyclopenta(c)quinoline8carboxylate
COC(=O)C1=CC=CC=C1OC(=O)C2=CC3=C(C=C2)NC(C4C3C=CC4)C5=CC=C(C=C5)(N+)(=O)(O)
COC(=O)c1ccccc1OC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC27H22N2O6c13427(31)21523824(21)3526(30)1711142322(1517)1964720(19)25(2823)1691218(131016)29(32)33h2681519202528H7H21H3
MFCD03674863
ZINC000009076114
ZINC000226973044
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