[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 3-(aminocarbonylamino)-3-phenyl-propanoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 3-(aminocarbonylamino)-3-phenyl-propanoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 3-phenyl-3-ureido-propanoate CAS Name: 3-(carbamoylamino)-3-phenylpropanoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 3-(carbamoylamino)-3-phenylpropanoate Traditional Name: 3-phenyl-3-ureido-propionic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C17H25N3O4 MolecularWeight: 335.3981

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)CC(C1=CC=CC=C1)NC(=O)N

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)CC(C1=CC=CC=C1)NC(=O)N

InChI

InChI=1S/C17H25N3O4/c1-3-13(4-2)19-15(21)11-24-16(22)10-14(20-17(18)23)12-8-6-5-7-9-12/h5-9,13-14H,3-4,10-11H2,1-2H3,(H,19,21)(H3,18,20,23)