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

Systemtic Name: 3-[(3-chloranyl-4-methoxy-phenyl)methyl]-1-cyclohexyl-2-oxidanylidene-benzimidazole-5-carbonitrile Openeye Name: 3-[(3-chloro-4-methoxy-phenyl)methyl]-1-cyclohexyl-2-oxo-benzimidazole-5-carbonitrile CAS Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-cyclohexyl-2-oxo-5-benzimidazolecarbonitrile IUPAC Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-cyclohexyl-2-oxobenzimidazole-5-carbonitrile Traditional Name: 3-(3-chloro-4-methoxy-benzyl)-1-cyclohexyl-2-keto-benzimidazole-5-carbonitrile Formula: C22H22ClN3O2 MolecularWeight: 395.88198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)C#N)N(C2=O)C4CCCCC4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)C#N)N(C2=O)C4CCCCC4)Cl

InChI

InChI=1S/C22H22ClN3O2/c1-28-21-10-8-16(11-18(21)23)14-25-20-12-15(13-24)7-9-19(20)26(22(25)27)17-5-3-2-4-6-17/h7-12,17H,2-6,14H2,1H3