3-(2-azanyl-5-cyano-benzimidazol-1-yl)propanoic acid

Systemtic Name: 3-(2-azanyl-5-cyano-benzimidazol-1-yl)propanoic acid Openeye Name: 3-(2-amino-5-cyano-benzimidazol-1-yl)propanoic acid CAS Name: 3-(2-amino-5-cyano-1-benzimidazolyl)propanoic acid IUPAC Name: 3-(2-amino-5-cyanobenzimidazol-1-yl)propanoic acid Traditional Name: 3-(2-amino-5-cyano-benzimidazol-1-yl)propionic acid Formula: C11H10N4O2 MolecularWeight: 230.2227

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C#N)N=C(N2CCC(=O)O)N

Isomeric SMILES

C1=CC2=C(C=C1C#N)N=C(N2CCC(=O)O)N

InChI

InChI=1S/C11H10N4O2/c12-6-7-1-2-9-8(5-7)14-11(13)15(9)4-3-10(16)17/h1-2,5H,3-4H2,(H2,13,14)(H,16,17)