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

Systemtic Name: butyl 1-methyl-4-[4-(4-pentylphenyl)cyclohexyl]cyclohexane-1-carboxylate Openeye Name: butyl 1-methyl-4-[4-(4-pentylphenyl)cyclohexyl]cyclohexanecarboxylate CAS Name: 1-methyl-4-[4-(4-pentylphenyl)cyclohexyl]-1-cyclohexanecarboxylic acid butyl ester IUPAC Name: butyl 1-methyl-4-[4-(4-pentylphenyl)cyclohexyl]cyclohexane-1-carboxylate Traditional Name: 4-[4-(4-amylphenyl)cyclohexyl]-1-methyl-cyclohexanecarboxylic acid butyl ester Formula: C29H46O2 MolecularWeight: 426.67434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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