ethyl 3-[(2-bromophenyl)methyl]-2-propyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 3-[(2-bromophenyl)methyl]-2-propyl-benzimidazole-5-carboxylate Openeye Name: ethyl 3-[(2-bromophenyl)methyl]-2-propyl-benzimidazole-5-carboxylate CAS Name: 3-[(2-bromophenyl)methyl]-2-propyl-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-bromophenyl)methyl]-2-propylbenzimidazole-5-carboxylate Traditional Name: 3-(2-bromobenzyl)-2-propyl-benzimidazole-5-carboxylic acid ethyl ester Formula: C20H21BrN2O2 MolecularWeight: 401.29694

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1CC3=CC=CC=C3Br)C=C(C=C2)C(=O)OCC

Isomeric SMILES

CCCC1=NC2=C(N1CC3=CC=CC=C3Br)C=C(C=C2)C(=O)OCC

InChI

InChI=1S/C20H21BrN2O2/c1-3-7-19-22-17-11-10-14(20(24)25-4-2)12-18(17)23(19)13-15-8-5-6-9-16(15)21/h5-6,8-12H,3-4,7,13H2,1-2H3