4-[5-[2-(1-pentan-2-ylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzenecarbonitrile

Systemtic Name: 4-[5-[2-(1-pentan-2-ylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzenecarbonitrile Openeye Name: 4-[5-[2-[1-(1-methylbutyl)cyclohexyl]ethyl]-1,3-dioxan-2-yl]benzonitrile CAS Name: 4-[5-[2-(1-pentan-2-ylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzonitrile IUPAC Name: 4-[5-[2-(1-pentan-2-ylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzonitrile Traditional Name: 4-[5-[2-[1-(1-methylbutyl)cyclohexyl]ethyl]-1,3-dioxan-2-yl]benzonitrile Formula: C24H35NO2 MolecularWeight: 369.5402

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1(CCCCC1)CCC2COC(OC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCC(C)C1(CCCCC1)CCC2COC(OC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H35NO2/c1-3-7-19(2)24(13-5-4-6-14-24)15-12-21-17-26-23(27-18-21)22-10-8-20(16-25)9-11-22/h8-11,19,21,23H,3-7,12-15,17-18H2,1-2H3