[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-methoxy-benzoate

Systemtic Name: [2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-methoxy-benzoate Openeye Name: [2-(3-cyanoanilino)-2-oxo-ethyl] 5-[(1,3-dioxoisoindolin-2-yl)methyl]-2-methoxy-benzoate CAS Name: 5-[(1,3-dioxo-2-isoindolyl)methyl]-2-methoxybenzoic acid [2-(3-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-cyanoanilino)-2-oxoethyl] 5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxybenzoate Traditional Name: 2-methoxy-5-(phthalimidomethyl)benzoic acid [2-(3-cyanoanilino)-2-keto-ethyl] ester Formula: C26H19N3O6 MolecularWeight: 469.44556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)OCC(=O)NC4=CC=CC(=C4)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)OCC(=O)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C26H19N3O6/c1-34-22-10-9-17(14-29-24(31)19-7-2-3-8-20(19)25(29)32)12-21(22)26(33)35-15-23(30)28-18-6-4-5-16(11-18)13-27/h2-12H,14-15H2,1H3,(H,28,30)