4-[3-[2-(2-nitrophenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-2-oxidanylidene-indol-1-yl]butanenitrile

Systemtic Name: 4-[3-[2-(2-nitrophenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-2-oxidanylidene-indol-1-yl]butanenitrile Openeye Name: 4-[3-hydroxy-3-[2-(2-nitrophenyl)-2-oxo-ethyl]-2-oxo-indolin-1-yl]butanenitrile CAS Name: 4-[3-hydroxy-3-[2-(2-nitrophenyl)-2-oxoethyl]-2-oxo-1-indolyl]butanenitrile IUPAC Name: 4-[3-hydroxy-3-[2-(2-nitrophenyl)-2-oxoethyl]-2-oxoindol-1-yl]butanenitrile Traditional Name: 4-[3-hydroxy-2-keto-3-[2-keto-2-(2-nitrophenyl)ethyl]indolin-1-yl]butyronitrile Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O5/c21-11-5-6-12-22-17-10-4-2-8-15(17)20(26,19(22)25)13-18(24)14-7-1-3-9-16(14)23(27)28/h1-4,7-10,26H,5-6,12-13H2