methyl 2-[[2-(3-oxidanylidene-1H-isoindol-2-yl)-3-phenyl-propanoyl]amino]benzoate

Systemtic Name: methyl 2-[[2-(3-oxidanylidene-1H-isoindol-2-yl)-3-phenyl-propanoyl]amino]benzoate Openeye Name: methyl 2-[[2-(1-oxoisoindolin-2-yl)-3-phenyl-propanoyl]amino]benzoate CAS Name: 2-[[1-oxo-2-(3-oxo-1H-isoindol-2-yl)-3-phenylpropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(3-oxo-1H-isoindol-2-yl)-3-phenylpropanoyl]amino]benzoate Traditional Name: 2-[[2-(1-ketoisoindolin-2-yl)-3-phenyl-propanoyl]amino]benzoic acid methyl ester Formula: C25H22N2O4 MolecularWeight: 414.45318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C(CC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C(CC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H22N2O4/c1-31-25(30)20-13-7-8-14-21(20)26-23(28)22(15-17-9-3-2-4-10-17)27-16-18-11-5-6-12-19(18)24(27)29/h2-14,22H,15-16H2,1H3,(H,26,28)