propan-2-yl 3-[2-(benzimidazol-1-yl)propanoylamino]-3-(4-methylphenyl)propanoate

Systemtic Name: propan-2-yl 3-[2-(benzimidazol-1-yl)propanoylamino]-3-(4-methylphenyl)propanoate Openeye Name: isopropyl 3-[2-(benzimidazol-1-yl)propanoylamino]-3-(p-tolyl)propanoate CAS Name: 3-[[2-(1-benzimidazolyl)-1-oxopropyl]amino]-3-(4-methylphenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[2-(benzimidazol-1-yl)propanoylamino]-3-(4-methylphenyl)propanoate Traditional Name: 3-[2-(benzimidazol-1-yl)propanoylamino]-3-(p-tolyl)propionic acid isopropyl ester Formula: C23H27N3O3 MolecularWeight: 393.47878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC(C)C)NC(=O)C(C)N2C=NC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)OC(C)C)NC(=O)C(C)N2C=NC3=CC=CC=C32

InChI

InChI=1S/C23H27N3O3/c1-15(2)29-22(27)13-20(18-11-9-16(3)10-12-18)25-23(28)17(4)26-14-24-19-7-5-6-8-21(19)26/h5-12,14-15,17,20H,13H2,1-4H3,(H,25,28)