4-[(1-methylbenzimidazol-5-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(1-methylbenzimidazol-5-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(1-methylbenzimidazol-5-yl)amino]-4-oxo-butanoic acid CAS Name: 4-[(1-methyl-5-benzimidazolyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[(1-methylbenzimidazol-5-yl)amino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[(1-methylbenzimidazol-5-yl)amino]butyric acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C=CC(=C2)NC(=O)CCC(=O)O

Isomeric SMILES

CN1C=NC2=C1C=CC(=C2)NC(=O)CCC(=O)O

InChI

InChI=1S/C12H13N3O3/c1-15-7-13-9-6-8(2-3-10(9)15)14-11(16)4-5-12(17)18/h2-3,6-7H,4-5H2,1H3,(H,14,16)(H,17,18)