ethyl 1-methyl-4-[4-(4-pentylphenyl)cyclohexyl]cyclohexane-1-carboxylate

Systemtic Name: ethyl 1-methyl-4-[4-(4-pentylphenyl)cyclohexyl]cyclohexane-1-carboxylate Openeye Name: ethyl 1-methyl-4-[4-(4-pentylphenyl)cyclohexyl]cyclohexanecarboxylate CAS Name: 1-methyl-4-[4-(4-pentylphenyl)cyclohexyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-4-[4-(4-pentylphenyl)cyclohexyl]cyclohexane-1-carboxylate Traditional Name: 4-[4-(4-amylphenyl)cyclohexyl]-1-methyl-cyclohexanecarboxylic acid ethyl ester Formula: C27H42O2 MolecularWeight: 398.62118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H42O2/c1-4-6-7-8-21-9-11-22(12-10-21)23-13-15-24(16-14-23)25-17-19-27(3,20-18-25)26(28)29-5-2/h9-12,23-25H,4-8,13-20H2,1-3H3