Vitas-M small molecule compound
2-(4-methyl-3-nitrophenyl)-2-oxoethyl 2-(3,4-dimethylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Catalog ID
STK269496
SMILES O=C(c1ccc2c(c1)C(=O)N(C2=O)c1ccc(c(c1)C)C)OCC(=O)c1ccc(c(c1)[N+](=O)[O-])C
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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 C26H20N2O7 MW 472.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N2O7/c1-14-5-8-19(10-16(14)3)27-24(30)20-9-7-18(11-21(20)25(27)31)26(32)35-13-23(29)17-6-4-15(2)22(12-17)28(33)34/h4-12H,13H2,1-3H3InChIKey
HEMVSWIFJXISFY-UHFFFAOYSA-NSynonyms
(2(4METHYL3NITROPHENYL)2OXOETHYL)2(34DIMETHYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
2(4methyl3nitrophenyl)2oxoethyl2(34dimethylphenyl)13dioxo23dihydro1Hisoindole5carboxylate
CC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC(=C(C=C4)C)(N+)(=O)(O))C
InChI=1SC26H20N2O7c1145819(1016(14)3)2724(30)209718(1121(20)25(27)31)26(32)351323(29)176415(2)22(1217)28(33)34h412H13H213H3
MFCD02318439
O=C(c1ccc2c(c1)C(=O)N(C2=O)c1ccc(c(c1)C)C)OCC(=O)c1ccc(c(c1)(N+)(=O)(O))C
ZINC000001172150
ZINC01172150
ZINC1172150
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