[2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] 3-(aminocarbonylamino)-3-phenyl-propanoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] 3-(aminocarbonylamino)-3-phenyl-propanoate Openeye Name: [2-[benzyl(isopropyl)amino]-2-oxo-ethyl] 3-phenyl-3-ureido-propanoate CAS Name: 3-(carbamoylamino)-3-phenylpropanoic acid [2-oxo-2-[(phenylmethyl)-propan-2-ylamino]ethyl] ester IUPAC Name: [2-[benzyl(propan-2-yl)amino]-2-oxoethyl] 3-(carbamoylamino)-3-phenylpropanoate Traditional Name: 3-phenyl-3-ureido-propionic acid [2-[benzyl(isopropyl)amino]-2-keto-ethyl] ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C(=O)COC(=O)CC(C2=CC=CC=C2)NC(=O)N

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C(=O)COC(=O)CC(C2=CC=CC=C2)NC(=O)N

InChI

InChI=1S/C22H27N3O4/c1-16(2)25(14-17-9-5-3-6-10-17)20(26)15-29-21(27)13-19(24-22(23)28)18-11-7-4-8-12-18/h3-12,16,19H,13-15H2,1-2H3,(H3,23,24,28)