2-[[(3-chloranyl-4-methoxy-phenyl)amino]methylidene]-3-methyl-1-oxidanylidene-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile

Systemtic Name: 2-[[(3-chloranyl-4-methoxy-phenyl)amino]methylidene]-3-methyl-1-oxidanylidene-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Openeye Name: 2-[(3-chloro-4-methoxy-anilino)methylene]-3-methyl-1-oxo-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile CAS Name: 2-[(3-chloro-4-methoxyanilino)methylidene]-3-methyl-1-oxo-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile IUPAC Name: 2-[(3-chloro-4-methoxyanilino)methylidene]-3-methyl-1-oxo-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Traditional Name: 2-[(3-chloro-4-methoxy-anilino)methylene]-1-keto-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-4-carbonitrile Formula: C21H16ClN4O2+ MolecularWeight: 391.83034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=[N+](C3=CC=CC=C3N2)C(=O)C1=CNC4=CC(=C(C=C4)OC)Cl)C#N

Isomeric SMILES

CC1=C(C2=[N+](C3=CC=CC=C3N2)C(=O)C1=CNC4=CC(=C(C=C4)OC)Cl)C#N

InChI

InChI=1S/C21H15ClN4O2/c1-12-14(10-23)20-25-17-5-3-4-6-18(17)26(20)21(27)15(12)11-24-13-7-8-19(28-2)16(22)9-13/h3-9,11H,1-2H3,(H,24,25,27)/p+1