hexyl 4-[4-(4-methoxyphenyl)cyclohexen-1-yl]cyclohex-3-ene-1-carboxylate

Systemtic Name: hexyl 4-[4-(4-methoxyphenyl)cyclohexen-1-yl]cyclohex-3-ene-1-carboxylate Openeye Name: hexyl 4-[4-(4-methoxyphenyl)cyclohexen-1-yl]cyclohex-3-ene-1-carboxylate CAS Name: 4-[4-(4-methoxyphenyl)-1-cyclohexenyl]-1-cyclohex-3-enecarboxylic acid hexyl ester IUPAC Name: hexyl 4-[4-(4-methoxyphenyl)cyclohexen-1-yl]cyclohex-3-ene-1-carboxylate Traditional Name: 4-[4-(4-methoxyphenyl)cyclohexen-1-yl]cyclohex-3-ene-1-carboxylic acid hexyl ester Formula: C26H36O3 MolecularWeight: 396.56224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1CCC(=CC1)C2=CCC(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCCOC(=O)C1CCC(=CC1)C2=CCC(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H36O3/c1-3-4-5-6-19-29-26(27)24-13-11-22(12-14-24)20-7-9-21(10-8-20)23-15-17-25(28-2)18-16-23/h7,11,15-18,21,24H,3-6,8-10,12-14,19H2,1-2H3