ethyl 3-(isoquinolin-3-ylmethyl)-2-methyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 3-(isoquinolin-3-ylmethyl)-2-methyl-benzimidazole-5-carboxylate Openeye Name: ethyl 3-(3-isoquinolylmethyl)-2-methyl-benzimidazole-5-carboxylate CAS Name: 3-(3-isoquinolinylmethyl)-2-methyl-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(isoquinolin-3-ylmethyl)-2-methylbenzimidazole-5-carboxylate Traditional Name: 3-(3-isoquinolylmethyl)-2-methyl-benzimidazole-5-carboxylic acid ethyl ester Formula: C21H19N3O2 MolecularWeight: 345.39446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(N2CC3=CC4=CC=CC=C4C=N3)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(N2CC3=CC4=CC=CC=C4C=N3)C

InChI

InChI=1S/C21H19N3O2/c1-3-26-21(25)16-8-9-19-20(11-16)24(14(2)23-19)13-18-10-15-6-4-5-7-17(15)12-22-18/h4-12H,3,13H2,1-2H3