[6-(4-octoxyphenyl)pyridin-3-yl] 4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carboxylate

Systemtic Name: [6-(4-octoxyphenyl)pyridin-3-yl] 4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carboxylate Openeye Name: [6-(4-octoxyphenyl)-3-pyridyl] 4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carboxylate CAS Name: 4-(4-methylpent-3-enyl)-1-cyclohex-3-enecarboxylic acid [6-(4-octoxyphenyl)-3-pyridinyl] ester IUPAC Name: [6-(4-octoxyphenyl)pyridin-3-yl] 4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carboxylate Traditional Name: 4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carboxylic acid [6-(4-octoxyphenyl)-3-pyridyl] ester Formula: C32H43NO3 MolecularWeight: 489.68872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=C2)OC(=O)C3CCC(=CC3)CCC=C(C)C

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=C2)OC(=O)C3CCC(=CC3)CCC=C(C)C

InChI

InChI=1S/C32H43NO3/c1-4-5-6-7-8-9-23-35-29-19-17-27(18-20-29)31-22-21-30(24-33-31)36-32(34)28-15-13-26(14-16-28)12-10-11-25(2)3/h11,13,17-22,24,28H,4-10,12,14-16,23H2,1-3H3