[4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]phenyl] 2-chloranylquinoline-3-carboxylate

Systemtic Name: [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]phenyl] 2-chloranylquinoline-3-carboxylate Openeye Name: [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]phenyl] 2-chloroquinoline-3-carboxylate CAS Name: 2-chloro-3-quinolinecarboxylic acid [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenyl] 2-chloroquinoline-3-carboxylate Traditional Name: 2-chloroquinoline-3-carboxylic acid [4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]phenyl] ester Formula: C26H15ClN4O2 MolecularWeight: 450.8759

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)Cl)C(=O)OC3=CC=C(C=C3)C=C(C#N)C4=NC5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)Cl)C(=O)OC3=CC=C(C=C3)/C=C(\C#N)/C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C26H15ClN4O2/c27-24-20(14-17-5-1-2-6-21(17)29-24)26(32)33-19-11-9-16(10-12-19)13-18(15-28)25-30-22-7-3-4-8-23(22)31-25/h1-14H,(H,30,31)/b18-13+