[4-(2-cyanophenyl)phenyl]methyl 4-benzamidobutanoate

Systemtic Name: [4-(2-cyanophenyl)phenyl]methyl 4-benzamidobutanoate Openeye Name: [4-(2-cyanophenyl)phenyl]methyl 4-benzamidobutanoate CAS Name: 4-benzamidobutanoic acid [4-(2-cyanophenyl)phenyl]methyl ester IUPAC Name: [4-(2-cyanophenyl)phenyl]methyl 4-benzamidobutanoate Traditional Name: 4-benzamidobutyric acid [4-(2-cyanophenyl)benzyl] ester Formula: C25H22N2O3 MolecularWeight: 398.45378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCCCC(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCCCC(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C25H22N2O3/c26-17-22-9-4-5-10-23(22)20-14-12-19(13-15-20)18-30-24(28)11-6-16-27-25(29)21-7-2-1-3-8-21/h1-5,7-10,12-15H,6,11,16,18H2,(H,27,29)