(4-cyano-1-oxidanylidene-2-phenyl-5H-pyrido[1,2-a]benzimidazol-3-yl)methyl benzoate

Systemtic Name: (4-cyano-1-oxidanylidene-2-phenyl-5H-pyrido[1,2-a]benzimidazol-3-yl)methyl benzoate Openeye Name: (4-cyano-1-oxo-2-phenyl-5H-pyrido[1,2-a]benzimidazol-3-yl)methyl benzoate CAS Name: benzoic acid (4-cyano-1-oxo-2-phenyl-5H-pyrido[1,2-a]benzimidazol-3-yl)methyl ester IUPAC Name: (4-cyano-1-oxo-2-phenyl-5H-pyrido[1,2-a]benzimidazol-3-yl)methyl benzoate Traditional Name: benzoic acid (4-cyano-1-keto-2-phenyl-5H-pyrido[1,2-a]benzimidazol-3-yl)methyl ester Formula: C26H17N3O3 MolecularWeight: 419.43148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=C3NC4=CC=CC=C4N3C2=O)C#N)COC(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=C3NC4=CC=CC=C4N3C2=O)C#N)COC(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H17N3O3/c27-15-19-20(16-32-26(31)18-11-5-2-6-12-18)23(17-9-3-1-4-10-17)25(30)29-22-14-8-7-13-21(22)28-24(19)29/h1-14,28H,16H2