pentyl 4-chloranyl-3-[(3-oxidanylidene-3-phenyl-propanoyl)amino]benzoate

Systemtic Name: pentyl 4-chloranyl-3-[(3-oxidanylidene-3-phenyl-propanoyl)amino]benzoate Openeye Name: pentyl 4-chloro-3-[(3-oxo-3-phenyl-propanoyl)amino]benzoate CAS Name: 4-chloro-3-[(1,3-dioxo-3-phenylpropyl)amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-chloro-3-[(3-oxo-3-phenylpropanoyl)amino]benzoate Traditional Name: 4-chloro-3-[(3-keto-3-phenyl-propanoyl)amino]benzoic acid amyl ester Formula: C21H22ClNO4 MolecularWeight: 387.85668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCOC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H22ClNO4/c1-2-3-7-12-27-21(26)16-10-11-17(22)18(13-16)23-20(25)14-19(24)15-8-5-4-6-9-15/h4-6,8-11,13H,2-3,7,12,14H2,1H3,(H,23,25)