(4-methylphenyl) 5-[4-[(E)-2-(4-butylcyclohexyl)ethenyl]cyclohexyl]pyridine-2-carboxylate

Systemtic Name: (4-methylphenyl) 5-[4-[(E)-2-(4-butylcyclohexyl)ethenyl]cyclohexyl]pyridine-2-carboxylate Openeye Name: p-tolyl 5-[4-[(E)-2-(4-butylcyclohexyl)vinyl]cyclohexyl]pyridine-2-carboxylate CAS Name: 5-[4-[(E)-2-(4-butylcyclohexyl)ethenyl]cyclohexyl]-2-pyridinecarboxylic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 5-[4-[(E)-2-(4-butylcyclohexyl)ethenyl]cyclohexyl]pyridine-2-carboxylate Traditional Name: 5-[4-[(E)-2-(4-butylcyclohexyl)vinyl]cyclohexyl]picolinic acid p-tolyl ester Formula: C31H41NO2 MolecularWeight: 459.66274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C=CC2CCC(CC2)C3=CN=C(C=C3)C(=O)OC4=CC=C(C=C4)C

Isomeric SMILES

CCCCC1CCC(CC1)/C=C/C2CCC(CC2)C3=CN=C(C=C3)C(=O)OC4=CC=C(C=C4)C

InChI

InChI=1S/C31H41NO2/c1-3-4-5-24-8-10-25(11-9-24)12-13-26-14-16-27(17-15-26)28-18-21-30(32-22-28)31(33)34-29-19-6-23(2)7-20-29/h6-7,12-13,18-22,24-27H,3-5,8-11,14-17H2,1-2H3/b13-12+