2-[(4-cyanophenyl)methyl]-7-methoxy-1H-benzimidazole-4-carboxylic acid

Systemtic Name: 2-[(4-cyanophenyl)methyl]-7-methoxy-1H-benzimidazole-4-carboxylic acid Openeye Name: 2-[(4-cyanophenyl)methyl]-7-methoxy-1H-benzimidazole-4-carboxylic acid CAS Name: 2-[(4-cyanophenyl)methyl]-7-methoxy-1H-benzimidazole-4-carboxylic acid IUPAC Name: 2-[(4-cyanophenyl)methyl]-7-methoxy-1H-benzimidazole-4-carboxylic acid Traditional Name: 2-(4-cyanobenzyl)-7-methoxy-1H-benzimidazole-4-carboxylic acid Formula: C17H13N3O3 MolecularWeight: 307.30342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C(=O)O)N=C(N2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=C2C(=C(C=C1)C(=O)O)N=C(N2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H13N3O3/c1-23-13-7-6-12(17(21)22)15-16(13)20-14(19-15)8-10-2-4-11(9-18)5-3-10/h2-7H,8H2,1H3,(H,19,20)(H,21,22)