(4-cyano-4-heptyl-cyclohexyl) 4-propoxybenzoate

Systemtic Name: (4-cyano-4-heptyl-cyclohexyl) 4-propoxybenzoate Openeye Name: (4-cyano-4-heptyl-cyclohexyl) 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid (4-cyano-4-heptylcyclohexyl) ester IUPAC Name: (4-cyano-4-heptylcyclohexyl) 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid (4-cyano-4-heptyl-cyclohexyl) ester Formula: C24H35NO3 MolecularWeight: 385.5396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(CCC(CC1)OC(=O)C2=CC=C(C=C2)OCCC)C#N

Isomeric SMILES

CCCCCCCC1(CCC(CC1)OC(=O)C2=CC=C(C=C2)OCCC)C#N

InChI

InChI=1S/C24H35NO3/c1-3-5-6-7-8-15-24(19-25)16-13-22(14-17-24)28-23(26)20-9-11-21(12-10-20)27-18-4-2/h9-12,22H,3-8,13-18H2,1-2H3