Vitas-M small molecule compound
N-(4-methyl-2-nitrophenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-isochromene-6-carboxamide
Catalog ID
STL021746
SMILES Cc1ccc(c(c1)[N+](=O)[O-])NC(=O)c1ccc2c(c1)CC(OC2=O)c1ccccc1
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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 C23H18N2O5 MW 402.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O5/c1-14-7-10-19(20(11-14)25(28)29)24-22(26)16-8-9-18-17(12-16)13-21(30-23(18)27)15-5-3-2-4-6-15/h2-12,21H,13H2,1H3,(H,24,26)InChIKey
NFRVZHWJQFDIFO-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4)(N+)(=O)(O)
Cc1ccc(c(c1)(N+)(=O)(O))NC(=O)c1ccc2c(c1)CC(OC2=O)c1ccccc1
InChI=1SC23H18N2O5c11471019(20(1114)25(28)29)2422(26)16891817(1216)1321(3023(18)27)155324615h21221H13H21H3(H2426)
MFCD06438594
N(4METHYL2NITROPHENYL)(1OXO3PHENYLISOCHROMAN6YL)CARBOXAMIDE
N(4methyl2nitrophenyl)1oxo3phenyl34dihydro1Hisochromene6carboxamide
N(4METHYL2NITROPHENYL)1OXO3PHENYL34DIHYDROISOCHROMENE6CARBOXAMIDE
ZINC000004540046
ZINC000004540047
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