[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl] quinoxaline-6-carboxylate

Systemtic Name: [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl] quinoxaline-6-carboxylate Openeye Name: [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxo-propyl] quinoxaline-6-carboxylate CAS Name: 6-quinoxalinecarboxylic acid [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl] ester IUPAC Name: [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl] quinoxaline-6-carboxylate Traditional Name: quinoxaline-6-carboxylic acid [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-keto-propyl] ester Formula: C20H13N5O3 MolecularWeight: 371.34892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)COC(=O)C3=CC4=NC=CN=C4C=C3)N2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)COC(=O)C3=CC4=NC=CN=C4C=C3)N2

InChI

InChI=1S/C20H13N5O3/c21-10-13(19-24-15-3-1-2-4-16(15)25-19)18(26)11-28-20(27)12-5-6-14-17(9-12)23-8-7-22-14/h1-9,24-25H,11H2