2-[2,2-dimethyl-4-(4-methylphenyl)oxan-4-yl]ethanenitrile

Systemtic Name: 2-[2,2-dimethyl-4-(4-methylphenyl)oxan-4-yl]ethanenitrile Openeye Name: 2-[2,2-dimethyl-4-(p-tolyl)tetrahydropyran-4-yl]acetonitrile CAS Name: 2-[2,2-dimethyl-4-(4-methylphenyl)-4-oxanyl]acetonitrile IUPAC Name: 2-[2,2-dimethyl-4-(4-methylphenyl)oxan-4-yl]acetonitrile Traditional Name: 2-[2,2-dimethyl-4-(p-tolyl)tetrahydropyran-4-yl]acetonitrile Formula: C16H21NO MolecularWeight: 243.34404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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