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

Systemtic Name: 3-[(3-chloranyl-4-methoxy-phenyl)methyl]-1-cyclopentyl-2-oxidanylidene-benzimidazole-5-carbonitrile Openeye Name: 3-[(3-chloro-4-methoxy-phenyl)methyl]-1-cyclopentyl-2-oxo-benzimidazole-5-carbonitrile CAS Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-cyclopentyl-2-oxo-5-benzimidazolecarbonitrile IUPAC Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-cyclopentyl-2-oxobenzimidazole-5-carbonitrile Traditional Name: 3-(3-chloro-4-methoxy-benzyl)-1-cyclopentyl-2-keto-benzimidazole-5-carbonitrile Formula: C21H20ClN3O2 MolecularWeight: 381.8554

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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)C4CCCC4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)C#N)N(C2=O)C4CCCC4)Cl

InChI

InChI=1S/C21H20ClN3O2/c1-27-20-9-7-15(10-17(20)22)13-24-19-11-14(12-23)6-8-18(19)25(21(24)26)16-4-2-3-5-16/h6-11,16H,2-5,13H2,1H3