2-[(3-chloranyl-2-methyl-phenyl)amino]-6-cyano-1H-benzimidazole-4-carboxylic acid

Systemtic Name: 2-[(3-chloranyl-2-methyl-phenyl)amino]-6-cyano-1H-benzimidazole-4-carboxylic acid Openeye Name: 2-(3-chloro-2-methyl-anilino)-6-cyano-1H-benzimidazole-4-carboxylic acid CAS Name: 2-(3-chloro-2-methylanilino)-6-cyano-1H-benzimidazole-4-carboxylic acid IUPAC Name: 2-(3-chloro-2-methylanilino)-6-cyano-1H-benzimidazole-4-carboxylic acid Traditional Name: 2-(3-chloro-2-methyl-anilino)-6-cyano-1H-benzimidazole-4-carboxylic acid Formula: C16H11ClN4O2 MolecularWeight: 326.73714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC2=NC3=C(C=C(C=C3N2)C#N)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC2=NC3=C(C=C(C=C3N2)C#N)C(=O)O

InChI

InChI=1S/C16H11ClN4O2/c1-8-11(17)3-2-4-12(8)19-16-20-13-6-9(7-18)5-10(15(22)23)14(13)21-16/h2-6H,1H3,(H,22,23)(H2,19,20,21)