(4-cyanophenyl) 4-(4-octylcyclohexen-1-yl)benzoate

Systemtic Name: (4-cyanophenyl) 4-(4-octylcyclohexen-1-yl)benzoate Openeye Name: (4-cyanophenyl) 4-(4-octylcyclohexen-1-yl)benzoate CAS Name: 4-(4-octyl-1-cyclohexenyl)benzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 4-(4-octylcyclohexen-1-yl)benzoate Traditional Name: 4-(4-octylcyclohexen-1-yl)benzoic acid (4-cyanophenyl) ester Formula: C28H33NO2 MolecularWeight: 415.56712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(=CC1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCCC1CCC(=CC1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C28H33NO2/c1-2-3-4-5-6-7-8-22-9-13-24(14-10-22)25-15-17-26(18-16-25)28(30)31-27-19-11-23(21-29)12-20-27/h11-13,15-20,22H,2-10,14H2,1H3