methyl 4-[(E)-2-[4-(4-pentylphenyl)cyclohexyl]ethenyl]cyclohexane-1-carboxylate

Systemtic Name: methyl 4-[(E)-2-[4-(4-pentylphenyl)cyclohexyl]ethenyl]cyclohexane-1-carboxylate Openeye Name: methyl 4-[(E)-2-[4-(4-pentylphenyl)cyclohexyl]vinyl]cyclohexanecarboxylate CAS Name: 4-[(E)-2-[4-(4-pentylphenyl)cyclohexyl]ethenyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-[(E)-2-[4-(4-pentylphenyl)cyclohexyl]ethenyl]cyclohexane-1-carboxylate Traditional Name: 4-[(E)-2-[4-(4-amylphenyl)cyclohexyl]vinyl]cyclohexanecarboxylic acid methyl ester Formula: C27H40O2 MolecularWeight: 396.6053

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2CCC(CC2)C=CC3CCC(CC3)C(=O)OC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2CCC(CC2)/C=C/C3CCC(CC3)C(=O)OC

InChI

InChI=1S/C27H40O2/c1-3-4-5-6-21-9-15-24(16-10-21)25-17-11-22(12-18-25)7-8-23-13-19-26(20-14-23)27(28)29-2/h7-10,15-16,22-23,25-26H,3-6,11-14,17-20H2,1-2H3/b8-7+