(E,5R)-5-(1H-benzimidazol-2-yl)-5-cyano-4-oxidanylidene-pent-2-enoic acid

Systemtic Name: (E,5R)-5-(1H-benzimidazol-2-yl)-5-cyano-4-oxidanylidene-pent-2-enoic acid Openeye Name: (E,5R)-5-(1H-benzimidazol-2-yl)-5-cyano-4-oxo-pent-2-enoic acid CAS Name: (E,5R)-5-(1H-benzimidazol-2-yl)-5-cyano-4-oxo-2-pentenoic acid IUPAC Name: (E,5R)-5-(1H-benzimidazol-2-yl)-5-cyano-4-oxopent-2-enoic acid Traditional Name: (E,5R)-5-(1H-benzimidazol-2-yl)-5-cyano-4-keto-pent-2-enoic acid Formula: C13H9N3O3 MolecularWeight: 255.22886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)[C@@H](C#N)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C13H9N3O3/c14-7-8(11(17)5-6-12(18)19)13-15-9-3-1-2-4-10(9)16-13/h1-6,8H,(H,15,16)(H,18,19)/b6-5+/t8-/m0/s1