Vitas-M small molecule compound
3-methyl-N-(4-nitrophenyl)-1-oxo-3,4-dihydro-1H-isochromene-3-carboxamide
Catalog ID
STK865388
SMILES O=C(C1(C)OC(=O)c2c(C1)cccc2)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 C17H14N2O5 MW 326.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O5/c1-17(10-11-4-2-3-5-14(11)15(20)24-17)16(21)18-12-6-8-13(9-7-12)19(22)23/h2-9H,10H2,1H3,(H,18,21)InChIKey
OKDQBZHWPXBWKH-UHFFFAOYSA-NSynonyms
824944-98-13methylN(4nitrophenyl)1oxo34dihydro1Hisochromene3carboxamide
3METHYLN(4NITROPHENYL)1OXO4HISOCHROMENE3CARBOXAMIDE
3methylN(4nitrophenyl)1oxoisochroman3carboxamide
824944981
CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC17H14N2O5c117(1011423514(11)15(20)2417)16(21)18126813(9712)19(22)23h29H10H21H3(H1821)
MFCD04192678
O=C(C1(C)OC(=O)c2c(C1)cccc2)Nc1ccc(cc1)(N+)(=O)(O)
ZINC000005064928
ZINC000005064930
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