(4-cyano-4-heptyl-cyclohexyl) 4-propylbenzoate

Systemtic Name: (4-cyano-4-heptyl-cyclohexyl) 4-propylbenzoate Openeye Name: (4-cyano-4-heptyl-cyclohexyl) 4-propylbenzoate CAS Name: 4-propylbenzoic acid (4-cyano-4-heptylcyclohexyl) ester IUPAC Name: (4-cyano-4-heptylcyclohexyl) 4-propylbenzoate Traditional Name: 4-propylbenzoic acid (4-cyano-4-heptyl-cyclohexyl) ester Formula: C24H35NO2 MolecularWeight: 369.5402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H35NO2/c1-3-5-6-7-8-16-24(19-25)17-14-22(15-18-24)27-23(26)21-12-10-20(9-4-2)11-13-21/h10-13,22H,3-9,14-18H2,1-2H3