1-(3,5-dimethylphenyl)cycloheptane-1-carbonitrile

Systemtic Name: 1-(3,5-dimethylphenyl)cycloheptane-1-carbonitrile Openeye Name: 1-(3,5-dimethylphenyl)cycloheptanecarbonitrile CAS Name: 1-(3,5-dimethylphenyl)-1-cycloheptanecarbonitrile IUPAC Name: 1-(3,5-dimethylphenyl)cycloheptane-1-carbonitrile Traditional Name: 1-(3,5-dimethylphenyl)cycloheptanecarbonitrile Formula: C16H21N MolecularWeight: 227.34464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2(CCCCCC2)C#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2(CCCCCC2)C#N)C

InChI

InChI=1S/C16H21N/c1-13-9-14(2)11-15(10-13)16(12-17)7-5-3-4-6-8-16/h9-11H,3-8H2,1-2H3