4-[2-(6,6-dimethyl-2,3-dihydropyran-3-yl)propan-2-yl]benzenecarbonitrile

Systemtic Name: 4-[2-(6,6-dimethyl-2,3-dihydropyran-3-yl)propan-2-yl]benzenecarbonitrile Openeye Name: 4-[1-(6,6-dimethyl-2,3-dihydropyran-3-yl)-1-methyl-ethyl]benzonitrile CAS Name: 4-[2-(6,6-dimethyl-2,3-dihydropyran-3-yl)propan-2-yl]benzonitrile IUPAC Name: 4-[2-(6,6-dimethyl-2,3-dihydropyran-3-yl)propan-2-yl]benzonitrile Traditional Name: 4-[1-(6,6-dimethyl-2,3-dihydropyran-3-yl)-1-methyl-ethyl]benzonitrile Formula: C17H21NO MolecularWeight: 255.35474

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(CO1)C(C)(C)C2=CC=C(C=C2)C#N)C

Isomeric SMILES

CC1(C=CC(CO1)C(C)(C)C2=CC=C(C=C2)C#N)C

InChI

InChI=1S/C17H21NO/c1-16(2)10-9-15(12-19-16)17(3,4)14-7-5-13(11-18)6-8-14/h5-10,15H,12H2,1-4H3