Vitas-M small molecule compound
(3Z)-3-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-1,3-dihydro-2H-indol-2-one
Catalog ID
STL169055
SMILES COc1cc(/C=C/2\C(=O)Nc3c2cccc3)cc(c1O)[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 C16H12N2O5 MW 312.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O5/c1-23-14-8-9(7-13(15(14)19)18(21)22)6-11-10-4-2-3-5-12(10)17-16(11)20/h2-8,19H,1H3,(H,17,20)/b11-6-InChIKey
WPHSCZAUPDUDQR-WDZFZDKYSA-NSynonyms
679801-53-7(3Z)3((4HYDROXY3METHOXY5NITROPHENYL)METHYLIDENE)1HINDOL2ONE
(3Z)3(4hydroxy3methoxy5nitrobenzylidene)13dihydro2Hindol2one
679801537
COC1=CC(=CC(=C1O)(N+)(=O)(O))C=C2C3=CC=CC=C3NC2=O
COc1cc(C=C2C(=O)Nc3c2cccc3)cc(c1O)(N+)(=O)(O)
InChI=1SC16H12N2O5c1231489(713(15(14)19)18(21)22)61110423512(10)1716(11)20h2819H1H3(H1720)b116
MFCD03722360
ZINC000036624101
ZINC36624101
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