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

Systemtic Name: 3-[(3-chloranyl-4-methoxy-phenyl)methyl]-1-cycloheptyl-2-oxidanylidene-benzimidazole-5-carbonitrile Openeye Name: 3-[(3-chloro-4-methoxy-phenyl)methyl]-1-cycloheptyl-2-oxo-benzimidazole-5-carbonitrile CAS Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-cycloheptyl-2-oxo-5-benzimidazolecarbonitrile IUPAC Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-cycloheptyl-2-oxobenzimidazole-5-carbonitrile Traditional Name: 3-(3-chloro-4-methoxy-benzyl)-1-cycloheptyl-2-keto-benzimidazole-5-carbonitrile Formula: C23H24ClN3O2 MolecularWeight: 409.90856

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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)C4CCCCCC4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)C#N)N(C2=O)C4CCCCCC4)Cl

InChI

InChI=1S/C23H24ClN3O2/c1-29-22-11-9-17(12-19(22)24)15-26-21-13-16(14-25)8-10-20(21)27(23(26)28)18-6-4-2-3-5-7-18/h8-13,18H,2-7,15H2,1H3