4-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)butanoic acid

Systemtic Name: 4-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)butanoic acid Openeye Name: 4-(3-methyl-2-oxo-benzimidazol-1-yl)butanoic acid CAS Name: 4-(3-methyl-2-oxo-1-benzimidazolyl)butanoic acid IUPAC Name: 4-(3-methyl-2-oxobenzimidazol-1-yl)butanoic acid Traditional Name: 4-(2-keto-3-methyl-benzimidazol-1-yl)butyric acid Formula: C12H14N2O3 MolecularWeight: 234.25116

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCCC(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCCC(=O)O

InChI

InChI=1S/C12H14N2O3/c1-13-9-5-2-3-6-10(9)14(12(13)17)8-4-7-11(15)16/h2-3,5-6H,4,7-8H2,1H3,(H,15,16)