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

Systemtic Name: 2-methylpentyl 4-[4-(4-methoxyphenyl)cyclohexen-1-yl]cyclohex-3-ene-1-carboxylate Openeye Name: 2-methylpentyl 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 2-methylpentyl ester IUPAC Name: 2-methylpentyl 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 2-methylpentyl ester Formula: C26H36O3 MolecularWeight: 396.56224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H36O3/c1-4-5-19(2)18-29-26(27)24-12-10-22(11-13-24)20-6-8-21(9-7-20)23-14-16-25(28-3)17-15-23/h6,10,14-17,19,21,24H,4-5,7-9,11-13,18H2,1-3H3