ethyl 4-[2-(3,3-diphenylpropanoylamino)phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(3,3-diphenylpropanoylamino)phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-(3,3-diphenylpropanoylamino)benzoyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[2-[(1-oxo-3,3-diphenylpropyl)amino]phenyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3,3-diphenylpropanoylamino)benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-(3,3-diphenylpropanoylamino)benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C29H31N3O4 MolecularWeight: 485.57414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H31N3O4/c1-2-36-29(35)32-19-17-31(18-20-32)28(34)24-15-9-10-16-26(24)30-27(33)21-25(22-11-5-3-6-12-22)23-13-7-4-8-14-23/h3-16,25H,2,17-21H2,1H3,(H,30,33)