3-butan-2-yl-2-oxidanylidene-benzimidazole-1-carboxylic acid

Systemtic Name: 3-butan-2-yl-2-oxidanylidene-benzimidazole-1-carboxylic acid Openeye Name: 2-oxo-3-sec-butyl-benzimidazole-1-carboxylic acid CAS Name: 3-butan-2-yl-2-oxo-1-benzimidazolecarboxylic acid IUPAC Name: 3-butan-2-yl-2-oxobenzimidazole-1-carboxylic acid Traditional Name: 2-keto-3-sec-butyl-benzimidazole-1-carboxylic acid Formula: C12H14N2O3 MolecularWeight: 234.25116

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=CC=CC=C2N(C1=O)C(=O)O

Isomeric SMILES

CCC(C)N1C2=CC=CC=C2N(C1=O)C(=O)O

InChI

InChI=1S/C12H14N2O3/c1-3-8(2)13-9-6-4-5-7-10(9)14(11(13)15)12(16)17/h4-8H,3H2,1-2H3,(H,16,17)