2-azanyl-3-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)propanoic acid

Systemtic Name: 2-azanyl-3-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)propanoic acid Openeye Name: 2-amino-3-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)propanoic acid CAS Name: 2-amino-3-(1,3-dimethyl-2-oxo-5-benzimidazolyl)propanoic acid IUPAC Name: 2-amino-3-(1,3-dimethyl-2-oxobenzimidazol-5-yl)propanoic acid Traditional Name: 2-amino-3-(2-keto-1,3-dimethyl-benzimidazol-5-yl)propionic acid Formula: C12H15N3O3 MolecularWeight: 249.2658

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)CC(C(=O)O)N)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)CC(C(=O)O)N)N(C1=O)C

InChI

InChI=1S/C12H15N3O3/c1-14-9-4-3-7(5-8(13)11(16)17)6-10(9)15(2)12(14)18/h3-4,6,8H,5,13H2,1-2H3,(H,16,17)