phenyl 4-butyl-4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: phenyl 4-butyl-4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: phenyl 4-butyl-4-(4-pentylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-butyl-4-(4-pentylcyclohexyl)-1-cyclohexanecarboxylic acid phenyl ester IUPAC Name: phenyl 4-butyl-4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-amylcyclohexyl)-4-butyl-cyclohexanecarboxylic acid phenyl ester Formula: C28H44O2 MolecularWeight: 412.64776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2(CCC(CC2)C(=O)OC3=CC=CC=C3)CCCC

Isomeric SMILES

CCCCCC1CCC(CC1)C2(CCC(CC2)C(=O)OC3=CC=CC=C3)CCCC

InChI

InChI=1S/C28H44O2/c1-3-5-8-11-23-14-16-25(17-15-23)28(20-6-4-2)21-18-24(19-22-28)27(29)30-26-12-9-7-10-13-26/h7,9-10,12-13,23-25H,3-6,8,11,14-22H2,1-2H3