octyl 4-(4-butylphenyl)-4-oxidanyl-cyclohexane-1-carboxylate

Systemtic Name: octyl 4-(4-butylphenyl)-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: octyl 4-(4-butylphenyl)-4-hydroxy-cyclohexanecarboxylate CAS Name: 4-(4-butylphenyl)-4-hydroxy-1-cyclohexanecarboxylic acid octyl ester IUPAC Name: octyl 4-(4-butylphenyl)-4-hydroxycyclohexane-1-carboxylate Traditional Name: 4-(4-butylphenyl)-4-hydroxy-cyclohexanecarboxylic acid octyl ester Formula: C25H40O3 MolecularWeight: 388.5833

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1CCC(CC1)(C2=CC=C(C=C2)CCCC)O

Isomeric SMILES

CCCCCCCCOC(=O)C1CCC(CC1)(C2=CC=C(C=C2)CCCC)O

InChI

InChI=1S/C25H40O3/c1-3-5-7-8-9-10-20-28-24(26)22-16-18-25(27,19-17-22)23-14-12-21(13-15-23)11-6-4-2/h12-15,22,27H,3-11,16-20H2,1-2H3