3-phenylpropyl 5-[(3-benzamidophenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[(3-benzamidophenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-(3-benzamidoanilino)-5-oxo-pentanoate CAS Name: 5-(3-benzamidoanilino)-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-(3-benzamidoanilino)-5-oxopentanoate Traditional Name: 5-(3-benzamidoanilino)-5-keto-valeric acid 3-phenylpropyl ester Formula: C27H28N2O4 MolecularWeight: 444.52222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H28N2O4/c30-25(17-8-18-26(31)33-19-9-12-21-10-3-1-4-11-21)28-23-15-7-16-24(20-23)29-27(32)22-13-5-2-6-14-22/h1-7,10-11,13-16,20H,8-9,12,17-19H2,(H,28,30)(H,29,32)