3-phenylpropyl 4-oxidanylidene-4-[[3-(propanoylamino)phenyl]amino]butanoate

Systemtic Name: 3-phenylpropyl 4-oxidanylidene-4-[[3-(propanoylamino)phenyl]amino]butanoate Openeye Name: 3-phenylpropyl 4-oxo-4-[3-(propanoylamino)anilino]butanoate CAS Name: 4-oxo-4-[3-(1-oxopropylamino)anilino]butanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-oxo-4-[3-(propanoylamino)anilino]butanoate Traditional Name: 4-keto-4-(3-propionamidoanilino)butyric acid 3-phenylpropyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)NC(=O)CCC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)NC(=O)CCC(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C22H26N2O4/c1-2-20(25)23-18-11-6-12-19(16-18)24-21(26)13-14-22(27)28-15-7-10-17-8-4-3-5-9-17/h3-6,8-9,11-12,16H,2,7,10,13-15H2,1H3,(H,23,25)(H,24,26)