4-(4-butyl-3-methyl-cyclohexyl)benzenecarbonitrile

Systemtic Name: 4-(4-butyl-3-methyl-cyclohexyl)benzenecarbonitrile Openeye Name: 4-(4-butyl-3-methyl-cyclohexyl)benzonitrile CAS Name: 4-(4-butyl-3-methylcyclohexyl)benzonitrile IUPAC Name: 4-(4-butyl-3-methylcyclohexyl)benzonitrile Traditional Name: 4-(4-butyl-3-methyl-cyclohexyl)benzonitrile Formula: C18H25N MolecularWeight: 255.3978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1C)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCC1CCC(CC1C)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H25N/c1-3-4-5-16-10-11-18(12-14(16)2)17-8-6-15(13-19)7-9-17/h6-9,14,16,18H,3-5,10-12H2,1-2H3