2-(2-methylpropanoylamino)-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 2-(2-methylpropanoylamino)-3H-benzimidazole-5-carboxylic acid Openeye Name: 2-(2-methylpropanoylamino)-3H-benzimidazole-5-carboxylic acid CAS Name: 2-[(2-methyl-1-oxopropyl)amino]-3H-benzimidazole-5-carboxylic acid IUPAC Name: 2-(2-methylpropanoylamino)-3H-benzimidazole-5-carboxylic acid Traditional Name: 2-(isobutyrylamino)-3H-benzimidazole-5-carboxylic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)C(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)O

InChI

InChI=1S/C12H13N3O3/c1-6(2)10(16)15-12-13-8-4-3-7(11(17)18)5-9(8)14-12/h3-6H,1-2H3,(H,17,18)(H2,13,14,15,16)