[1-oxidanylidene-1-(propylamino)propan-2-yl] 2-methyl-1-phenyl-benzimidazole-5-carboxylate

Systemtic Name: [1-oxidanylidene-1-(propylamino)propan-2-yl] 2-methyl-1-phenyl-benzimidazole-5-carboxylate Openeye Name: [1-methyl-2-oxo-2-(propylamino)ethyl] 2-methyl-1-phenyl-benzimidazole-5-carboxylate CAS Name: 2-methyl-1-phenyl-5-benzimidazolecarboxylic acid [1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propylamino)propan-2-yl] 2-methyl-1-phenylbenzimidazole-5-carboxylate Traditional Name: 2-methyl-1-phenyl-benzimidazole-5-carboxylic acid [2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC2=C(C=C1)N(C(=N2)C)C3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)C(C)OC(=O)C1=CC2=C(C=C1)N(C(=N2)C)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O3/c1-4-12-22-20(25)14(2)27-21(26)16-10-11-19-18(13-16)23-15(3)24(19)17-8-6-5-7-9-17/h5-11,13-14H,4,12H2,1-3H3,(H,22,25)