methyl (2R)-2-[3-oxidanylidenebutanoyl-(phenylmethyl)amino]-3-phenyl-propanoate

Systemtic Name: methyl (2R)-2-[3-oxidanylidenebutanoyl-(phenylmethyl)amino]-3-phenyl-propanoate Openeye Name: methyl (2R)-2-[benzyl(3-oxobutanoyl)amino]-3-phenyl-propanoate CAS Name: (2R)-2-[1,3-dioxobutyl-(phenylmethyl)amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[benzyl(3-oxobutanoyl)amino]-3-phenylpropanoate Traditional Name: (2R)-2-[acetoacetyl(benzyl)amino]-3-phenyl-propionic acid methyl ester Formula: C21H23NO4 MolecularWeight: 353.41162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)N(CC1=CC=CC=C1)C(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(=O)CC(=O)N(CC1=CC=CC=C1)[C@H](CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C21H23NO4/c1-16(23)13-20(24)22(15-18-11-7-4-8-12-18)19(21(25)26-2)14-17-9-5-3-6-10-17/h3-12,19H,13-15H2,1-2H3/t19-/m1/s1