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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=CC2=C(C=C1)N(C(=N2)C)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=CC2=C(C=C1)N(C(=N2)C)C3=CC=CC=C3

InChI

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