Vitas-M small molecule compound

2-(4-bromophenyl)-2-oxoethyl 4-(4-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate

Catalog ID
STK548001
SMILES Brc1ccc(cc1)C(=O)COC(=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 C27H21BrN2O5 MW 533.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21BrN2O5/c28-19-9-4-16(5-10-19)25(31)15-35-27(32)18-8-13-24-23(14-18)21-2-1-3-22(21)26(29-24)17-6-11-20(12-7-17)30(33)34/h1-2,4-14,21-22,26,29H,3,15H2
InChIKey
ZIVIMSHYROSRCF-UHFFFAOYSA-N
Synonyms
359851-33-5
(2(4BROMOPHENYL)2OXOETHYL)4(4NITROPHENYL)3A459BTETRAHYDRO3HCYCLOPENTA(C)QUINOLINE8CARBOXYLATE
2(4bromophenyl)2oxoethyl4(4nitrophenyl)3a459btetrahydro3Hcyclopenta(c)quinoline8carboxylate
359851335
Brc1ccc(cc1)C(=O)COC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1)(N+)(=O)(O)
C1C=CC2C1C(NC3=C2C=C(C=C3)C(=O)OCC(=O)C4=CC=C(C=C4)Br)C5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC27H21BrN2O5c28199416(51019)25(31)153527(32)188132423(1418)2121322(21)26(2924)1761120(12717)30(33)34h1241421222629H315H2
MFCD01230486
ZINC000002348176
ZINC000226936637

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Available files

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