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

Systemtic Name: octyl 4-(4-hexylphenyl)-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: octyl 4-(4-hexylphenyl)-4-hydroxy-cyclohexanecarboxylate CAS Name: 4-(4-hexylphenyl)-4-hydroxy-1-cyclohexanecarboxylic acid octyl ester IUPAC Name: octyl 4-(4-hexylphenyl)-4-hydroxycyclohexane-1-carboxylate Traditional Name: 4-(4-hexylphenyl)-4-hydroxy-cyclohexanecarboxylic acid octyl ester Formula: C27H44O3 MolecularWeight: 416.63646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H44O3/c1-3-5-7-9-10-12-22-30-26(28)24-18-20-27(29,21-19-24)25-16-14-23(15-17-25)13-11-8-6-4-2/h14-17,24,29H,3-13,18-22H2,1-2H3