(1-oxidanylidene-1-phenylazanyl-butan-2-yl) 4-(acetamidomethyl)benzoate

Systemtic Name: (1-oxidanylidene-1-phenylazanyl-butan-2-yl) 4-(acetamidomethyl)benzoate Openeye Name: 1-(phenylcarbamoyl)propyl 4-(acetamidomethyl)benzoate CAS Name: 4-(acetamidomethyl)benzoic acid (1-anilino-1-oxobutan-2-yl) ester IUPAC Name: (1-anilino-1-oxobutan-2-yl) 4-(acetamidomethyl)benzoate Traditional Name: 4-(acetamidomethyl)benzoic acid 1-(phenylcarbamoyl)propyl ester Formula: C20H22N2O4 MolecularWeight: 354.39968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)CNC(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)CNC(=O)C

InChI

InChI=1S/C20H22N2O4/c1-3-18(19(24)22-17-7-5-4-6-8-17)26-20(25)16-11-9-15(10-12-16)13-21-14(2)23/h4-12,18H,3,13H2,1-2H3,(H,21,23)(H,22,24)