1-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-phenyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-phenyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-3-phenyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-phenyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-phenylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-3-phenyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C27H17N3O2 MolecularWeight: 415.44278

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CC3=CC(=C(C4=NC5=CC=CC=C5N34)C#N)C6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/C3=CC(=C(C4=NC5=CC=CC=C5N34)C#N)C6=CC=CC=C6

InChI

InChI=1S/C27H17N3O2/c28-16-22-21(19-6-2-1-3-7-19)15-20(30-24-9-5-4-8-23(24)29-27(22)30)12-10-18-11-13-25-26(14-18)32-17-31-25/h1-15H,17H2/b12-10+