4-[(4-cyano-4-heptyl-cyclohexyl)methoxymethyl]-1-heptyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-[(4-cyano-4-heptyl-cyclohexyl)methoxymethyl]-1-heptyl-cyclohexane-1-carbonitrile Openeye Name: 4-[(4-cyano-4-heptyl-cyclohexyl)methoxymethyl]-1-heptyl-cyclohexanecarbonitrile CAS Name: 4-[(4-cyano-4-heptylcyclohexyl)methoxymethyl]-1-heptyl-1-cyclohexanecarbonitrile IUPAC Name: 4-[(4-cyano-4-heptylcyclohexyl)methoxymethyl]-1-heptylcyclohexane-1-carbonitrile Traditional Name: 4-[(4-cyano-4-heptyl-cyclohexyl)methoxymethyl]-1-heptyl-cyclohexanecarbonitrile Formula: C30H52N2O MolecularWeight: 456.74668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(CCC(CC1)COCC2CCC(CC2)(CCCCCCC)C#N)C#N

Isomeric SMILES

CCCCCCCC1(CCC(CC1)COCC2CCC(CC2)(CCCCCCC)C#N)C#N

InChI

InChI=1S/C30H52N2O/c1-3-5-7-9-11-17-29(25-31)19-13-27(14-20-29)23-33-24-28-15-21-30(26-32,22-16-28)18-12-10-8-6-4-2/h27-28H,3-24H2,1-2H3