[2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] 3-[(4-chlorophenyl)carbonylamino]propanoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] 3-[(4-chlorophenyl)carbonylamino]propanoate Openeye Name: [2-[benzyl(isopropyl)amino]-2-oxo-ethyl] 3-[(4-chlorobenzoyl)amino]propanoate CAS Name: 3-[[(4-chlorophenyl)-oxomethyl]amino]propanoic acid [2-oxo-2-[(phenylmethyl)-propan-2-ylamino]ethyl] ester IUPAC Name: [2-[benzyl(propan-2-yl)amino]-2-oxoethyl] 3-[(4-chlorobenzoyl)amino]propanoate Traditional Name: 3-[(4-chlorobenzoyl)amino]propionic acid [2-[benzyl(isopropyl)amino]-2-keto-ethyl] ester Formula: C22H25ClN2O4 MolecularWeight: 416.8979

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C(=O)COC(=O)CCNC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C(=O)COC(=O)CCNC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H25ClN2O4/c1-16(2)25(14-17-6-4-3-5-7-17)20(26)15-29-21(27)12-13-24-22(28)18-8-10-19(23)11-9-18/h3-11,16H,12-15H2,1-2H3,(H,24,28)