methyl 4-[4-(4-butylphenyl)cyclohexyl]-1-pentyl-cyclohexane-1-carboxylate

Systemtic Name: methyl 4-[4-(4-butylphenyl)cyclohexyl]-1-pentyl-cyclohexane-1-carboxylate Openeye Name: methyl 4-[4-(4-butylphenyl)cyclohexyl]-1-pentyl-cyclohexanecarboxylate CAS Name: 4-[4-(4-butylphenyl)cyclohexyl]-1-pentyl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-(4-butylphenyl)cyclohexyl]-1-pentylcyclohexane-1-carboxylate Traditional Name: 1-amyl-4-[4-(4-butylphenyl)cyclohexyl]cyclohexanecarboxylic acid methyl ester Formula: C29H46O2 MolecularWeight: 426.67434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)CCCC)C(=O)OC

Isomeric SMILES

CCCCCC1(CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)CCCC)C(=O)OC

InChI

InChI=1S/C29H46O2/c1-4-6-8-20-29(28(30)31-3)21-18-27(19-22-29)26-16-14-25(15-17-26)24-12-10-23(11-13-24)9-7-5-2/h10-13,25-27H,4-9,14-22H2,1-3H3