Vitas-M small molecule compound
N-(4-nitrophenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-isochromene-6-carboxamide
Catalog ID
STL021736
SMILES O=C(c1ccc2c(c1)CC(OC2=O)c1ccccc1)Nc1ccc(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 C22H16N2O5 MW 388.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N2O5/c25-21(23-17-7-9-18(10-8-17)24(27)28)15-6-11-19-16(12-15)13-20(29-22(19)26)14-4-2-1-3-5-14/h1-12,20H,13H2,(H,23,25)InChIKey
PLBGUGUNAYHKGR-UHFFFAOYSA-NSynonyms
C1C(OC(=O)C2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)(N+)(=O)(O))C4=CC=CC=C4
InChI=1SC22H16N2O5c2521(23177918(10817)24(27)28)156111916(1215)1320(2922(19)26)144213514h11220H13H2(H2325)
MFCD06438581
N(4NITROPHENYL)(1OXO3PHENYLISOCHROMAN6YL)CARBOXAMIDE
N(4nitrophenyl)1oxo3phenyl34dihydro1Hisochromene6carboxamide
N(4NITROPHENYL)1OXO3PHENYL34DIHYDROISOCHROMENE6CARBOXAMIDE
O=C(c1ccc2c(c1)CC(OC2=O)c1ccccc1)Nc1ccc(cc1)(N+)(=O)(O)
ZINC000004540025
ZINC000004540026
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