2-methyl-1-(3-methylbutyl)benzimidazole-5-carboxylic acid

Systemtic Name: 2-methyl-1-(3-methylbutyl)benzimidazole-5-carboxylic acid Openeye Name: 1-isopentyl-2-methyl-benzimidazole-5-carboxylic acid CAS Name: 2-methyl-1-(3-methylbutyl)-5-benzimidazolecarboxylic acid IUPAC Name: 2-methyl-1-(3-methylbutyl)benzimidazole-5-carboxylic acid Traditional Name: 1-isoamyl-2-methyl-benzimidazole-5-carboxylic acid Formula: C14H18N2O2 MolecularWeight: 246.30492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CCC(C)C)C=CC(=C2)C(=O)O

Isomeric SMILES

CC1=NC2=C(N1CCC(C)C)C=CC(=C2)C(=O)O

InChI

InChI=1S/C14H18N2O2/c1-9(2)6-7-16-10(3)15-12-8-11(14(17)18)4-5-13(12)16/h4-5,8-9H,6-7H2,1-3H3,(H,17,18)