3-azanyl-4-(3,4,5-trimethoxyphenyl)carbonyl-pyrido[1,2-a]benzimidazole-2-carbonitrile

Systemtic Name: 3-azanyl-4-(3,4,5-trimethoxyphenyl)carbonyl-pyrido[1,2-a]benzimidazole-2-carbonitrile Openeye Name: 3-amino-4-(3,4,5-trimethoxybenzoyl)pyrido[1,2-a]benzimidazole-2-carbonitrile CAS Name: 3-amino-4-[oxo-(3,4,5-trimethoxyphenyl)methyl]-2-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-amino-4-(3,4,5-trimethoxybenzoyl)pyrido[1,2-a]benzimidazole-2-carbonitrile Traditional Name: 3-amino-4-(3,4,5-trimethoxybenzoyl)pyrido[1,2-a]benzimidazole-2-carbonitrile Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)C2=C(C(=CN3C2=NC4=CC=CC=C43)C#N)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)C2=C(C(=CN3C2=NC4=CC=CC=C43)C#N)N

InChI

InChI=1S/C22H18N4O4/c1-28-16-8-12(9-17(29-2)21(16)30-3)20(27)18-19(24)13(10-23)11-26-15-7-5-4-6-14(15)25-22(18)26/h4-9,11H,24H2,1-3H3