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

Systemtic Name: methyl 3-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-(4-methylphenyl)propanoate Openeye Name: methyl 3-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-(p-tolyl)propanoate CAS Name: 3-[[3-(1H-benzimidazol-2-yl)-1-oxopropyl]amino]-3-(4-methylphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-(4-methylphenyl)propanoate Traditional Name: 3-[3-(1H-benzimidazol-2-yl)propanoylamino]-3-(p-tolyl)propionic acid methyl ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)CCC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)CCC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C21H23N3O3/c1-14-7-9-15(10-8-14)18(13-21(26)27-2)24-20(25)12-11-19-22-16-5-3-4-6-17(16)23-19/h3-10,18H,11-13H2,1-2H3,(H,22,23)(H,24,25)