phenyl 4-pentyl-4-(4-propylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: phenyl 4-pentyl-4-(4-propylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: phenyl 4-pentyl-4-(4-propylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-pentyl-4-(4-propylcyclohexyl)-1-cyclohexanecarboxylic acid phenyl ester IUPAC Name: phenyl 4-pentyl-4-(4-propylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-amyl-4-(4-propylcyclohexyl)cyclohexanecarboxylic acid phenyl ester Formula: C27H42O2 MolecularWeight: 398.62118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(CCC(CC1)C(=O)OC2=CC=CC=C2)C3CCC(CC3)CCC

Isomeric SMILES

CCCCCC1(CCC(CC1)C(=O)OC2=CC=CC=C2)C3CCC(CC3)CCC

InChI

InChI=1S/C27H42O2/c1-3-5-9-19-27(24-15-13-22(10-4-2)14-16-24)20-17-23(18-21-27)26(28)29-25-11-7-6-8-12-25/h6-8,11-12,22-24H,3-5,9-10,13-21H2,1-2H3