3-[(3-chloranyl-4-methoxy-phenyl)methyl]-1-(1-methylpiperidin-4-yl)-2-oxidanylidene-benzimidazole-5-carbonitrile

Systemtic Name: 3-[(3-chloranyl-4-methoxy-phenyl)methyl]-1-(1-methylpiperidin-4-yl)-2-oxidanylidene-benzimidazole-5-carbonitrile Openeye Name: 3-[(3-chloro-4-methoxy-phenyl)methyl]-1-(1-methyl-4-piperidyl)-2-oxo-benzimidazole-5-carbonitrile CAS Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-(1-methyl-4-piperidinyl)-2-oxo-5-benzimidazolecarbonitrile IUPAC Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-(1-methylpiperidin-4-yl)-2-oxobenzimidazole-5-carbonitrile Traditional Name: 3-(3-chloro-4-methoxy-benzyl)-2-keto-1-(1-methyl-4-piperidyl)benzimidazole-5-carbonitrile Formula: C22H23ClN4O2 MolecularWeight: 410.89662

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N2C3=C(C=C(C=C3)C#N)N(C2=O)CC4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CN1CCC(CC1)N2C3=C(C=C(C=C3)C#N)N(C2=O)CC4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C22H23ClN4O2/c1-25-9-7-17(8-10-25)27-19-5-3-15(13-24)12-20(19)26(22(27)28)14-16-4-6-21(29-2)18(23)11-16/h3-6,11-12,17H,7-10,14H2,1-2H3