[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 2-methyl-1-phenyl-benzimidazole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 2-methyl-1-phenyl-benzimidazole-5-carboxylate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 2-methyl-1-phenyl-benzimidazole-5-carboxylate CAS Name: 2-methyl-1-phenyl-5-benzimidazolecarboxylic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 2-methyl-1-phenylbenzimidazole-5-carboxylate Traditional Name: 2-methyl-1-phenyl-benzimidazole-5-carboxylic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C24H21N3O3 MolecularWeight: 399.44184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)OCC(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)OCC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C24H21N3O3/c1-17-26-21-14-19(12-13-22(21)27(17)20-10-6-3-7-11-20)24(29)30-16-23(28)25-15-18-8-4-2-5-9-18/h2-14H,15-16H2,1H3,(H,25,28)