2,2-dimethyl-4-[(4-methylphenyl)methyl]oxane-4-carbonitrile

Systemtic Name: 2,2-dimethyl-4-[(4-methylphenyl)methyl]oxane-4-carbonitrile Openeye Name: 2,2-dimethyl-4-(p-tolylmethyl)tetrahydropyran-4-carbonitrile CAS Name: 2,2-dimethyl-4-[(4-methylphenyl)methyl]-4-oxanecarbonitrile IUPAC Name: 2,2-dimethyl-4-[(4-methylphenyl)methyl]oxane-4-carbonitrile Traditional Name: 2,2-dimethyl-4-(4-methylbenzyl)tetrahydropyran-4-carbonitrile Formula: C16H21NO MolecularWeight: 243.34404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2(CCOC(C2)(C)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)CC2(CCOC(C2)(C)C)C#N

InChI

InChI=1S/C16H21NO/c1-13-4-6-14(7-5-13)10-16(12-17)8-9-18-15(2,3)11-16/h4-7H,8-11H2,1-3H3