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

Systemtic Name: 3-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-phenyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-1-phenyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-phenyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-phenylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-1-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=C(C4=NC5=CC=CC=C5N4C(=C3)C6=CC=CC=C6)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/C3=C(C4=NC5=CC=CC=C5N4C(=C3)C6=CC=CC=C6)C#N

InChI

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