1-(4-cyanophenyl)-2-methyl-benzimidazole-5-carboxylic acid

Systemtic Name: 1-(4-cyanophenyl)-2-methyl-benzimidazole-5-carboxylic acid Openeye Name: 1-(4-cyanophenyl)-2-methyl-benzimidazole-5-carboxylic acid CAS Name: 1-(4-cyanophenyl)-2-methyl-5-benzimidazolecarboxylic acid IUPAC Name: 1-(4-cyanophenyl)-2-methylbenzimidazole-5-carboxylic acid Traditional Name: 1-(4-cyanophenyl)-2-methyl-benzimidazole-5-carboxylic acid Formula: C16H11N3O2 MolecularWeight: 277.27744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3=CC=C(C=C3)C#N)C=CC(=C2)C(=O)O

Isomeric SMILES

CC1=NC2=C(N1C3=CC=C(C=C3)C#N)C=CC(=C2)C(=O)O

InChI

InChI=1S/C16H11N3O2/c1-10-18-14-8-12(16(20)21)4-7-15(14)19(10)13-5-2-11(9-17)3-6-13/h2-8H,1H3,(H,20,21)