4-[3-[2-(4-methoxy-3-nitro-phenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-2-oxidanylidene-indol-1-yl]butanenitrile

Systemtic Name: 4-[3-[2-(4-methoxy-3-nitro-phenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-2-oxidanylidene-indol-1-yl]butanenitrile Openeye Name: 4-[3-hydroxy-3-[2-(4-methoxy-3-nitro-phenyl)-2-oxo-ethyl]-2-oxo-indolin-1-yl]butanenitrile CAS Name: 4-[3-hydroxy-3-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-2-oxo-1-indolyl]butanenitrile IUPAC Name: 4-[3-hydroxy-3-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-2-oxoindol-1-yl]butanenitrile Traditional Name: 4-[3-hydroxy-2-keto-3-[2-keto-2-(4-methoxy-3-nitro-phenyl)ethyl]indolin-1-yl]butyronitrile Formula: C21H19N3O6 MolecularWeight: 409.39206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CC2(C3=CC=CC=C3N(C2=O)CCCC#N)O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CC2(C3=CC=CC=C3N(C2=O)CCCC#N)O)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O6/c1-30-19-9-8-14(12-17(19)24(28)29)18(25)13-21(27)15-6-2-3-7-16(15)23(20(21)26)11-5-4-10-22/h2-3,6-9,12,27H,4-5,11,13H2,1H3