4-[(3R)-3-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-2-oxidanylidene-indol-1-yl]butanenitrile

Systemtic Name: 4-[(3R)-3-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-2-oxidanylidene-indol-1-yl]butanenitrile Openeye Name: 4-[(3R)-3-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]-3-hydroxy-2-oxo-indolin-1-yl]butanenitrile CAS Name: 4-[(3R)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-hydroxy-2-oxo-1-indolyl]butanenitrile IUPAC Name: 4-[(3R)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-hydroxy-2-oxoindol-1-yl]butanenitrile Traditional Name: 4-[(3R)-3-[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]-3-hydroxy-2-keto-indolin-1-yl]butyronitrile Formula: C22H22N2O5 MolecularWeight: 394.42048

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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)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C[C@]2(C3=CC=CC=C3N(C2=O)CCCC#N)O)OC

InChI

InChI=1S/C22H22N2O5/c1-28-19-10-9-15(13-20(19)29-2)18(25)14-22(27)16-7-3-4-8-17(16)24(21(22)26)12-6-5-11-23/h3-4,7-10,13,27H,5-6,12,14H2,1-2H3/t22-/m1/s1