hexyl 4-(2,3,3-triphenylpropanoylamino)benzoate

Systemtic Name: hexyl 4-(2,3,3-triphenylpropanoylamino)benzoate Openeye Name: hexyl 4-(2,3,3-triphenylpropanoylamino)benzoate CAS Name: 4-[(1-oxo-2,3,3-triphenylpropyl)amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-(2,3,3-triphenylpropanoylamino)benzoate Traditional Name: 4-(2,3,3-triphenylpropanoylamino)benzoic acid hexyl ester Formula: C34H35NO3 MolecularWeight: 505.6466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C34H35NO3/c1-2-3-4-14-25-38-34(37)29-21-23-30(24-22-29)35-33(36)32(28-19-12-7-13-20-28)31(26-15-8-5-9-16-26)27-17-10-6-11-18-27/h5-13,15-24,31-32H,2-4,14,25H2,1H3,(H,35,36)