5-cyano-5-(1,3-dihydrobenzimidazol-2-ylidene)-4-oxidanylidene-pentanoic acid

Systemtic Name: 5-cyano-5-(1,3-dihydrobenzimidazol-2-ylidene)-4-oxidanylidene-pentanoic acid Openeye Name: 5-cyano-5-(1,3-dihydrobenzimidazol-2-ylidene)-4-oxo-pentanoic acid CAS Name: 5-cyano-5-(1,3-dihydrobenzimidazol-2-ylidene)-4-oxopentanoic acid IUPAC Name: 5-cyano-5-(1,3-dihydrobenzimidazol-2-ylidene)-4-oxopentanoic acid Traditional Name: 5-cyano-5-(1,3-dihydrobenzimidazol-2-ylidene)-4-keto-valeric acid Formula: C13H11N3O3 MolecularWeight: 257.24474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)CCC(=O)O)N2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)CCC(=O)O)N2

InChI

InChI=1S/C13H11N3O3/c14-7-8(11(17)5-6-12(18)19)13-15-9-3-1-2-4-10(9)16-13/h1-4,15-16H,5-6H2,(H,18,19)