[2-oxidanylidene-2-(4-phenylbutan-2-ylamino)ethyl] 3-(aminocarbonylamino)-3-(4-chlorophenyl)propanoate

Systemtic Name: [2-oxidanylidene-2-(4-phenylbutan-2-ylamino)ethyl] 3-(aminocarbonylamino)-3-(4-chlorophenyl)propanoate Openeye Name: [2-[(1-methyl-3-phenyl-propyl)amino]-2-oxo-ethyl] 3-(4-chlorophenyl)-3-ureido-propanoate CAS Name: 3-(carbamoylamino)-3-(4-chlorophenyl)propanoic acid [2-oxo-2-(4-phenylbutan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylbutan-2-ylamino)ethyl] 3-(carbamoylamino)-3-(4-chlorophenyl)propanoate Traditional Name: 3-(4-chlorophenyl)-3-ureido-propionic acid [2-keto-2-[(1-methyl-3-phenyl-propyl)amino]ethyl] ester Formula: C22H26ClN3O4 MolecularWeight: 431.91254

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)COC(=O)CC(C2=CC=C(C=C2)Cl)NC(=O)N

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)COC(=O)CC(C2=CC=C(C=C2)Cl)NC(=O)N

InChI

InChI=1S/C22H26ClN3O4/c1-15(7-8-16-5-3-2-4-6-16)25-20(27)14-30-21(28)13-19(26-22(24)29)17-9-11-18(23)12-10-17/h2-6,9-12,15,19H,7-8,13-14H2,1H3,(H,25,27)(H3,24,26,29)