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

Systemtic Name: octyl 4-(4-hexoxyphenyl)-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: octyl 4-(4-hexoxyphenyl)-4-hydroxy-cyclohexanecarboxylate CAS Name: 4-(4-hexoxyphenyl)-4-hydroxy-1-cyclohexanecarboxylic acid octyl ester IUPAC Name: octyl 4-(4-hexoxyphenyl)-4-hydroxycyclohexane-1-carboxylate Traditional Name: 4-(4-hexoxyphenyl)-4-hydroxy-cyclohexanecarboxylic acid octyl ester Formula: C27H44O4 MolecularWeight: 432.63586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H44O4/c1-3-5-7-9-10-12-22-31-26(28)23-17-19-27(29,20-18-23)24-13-15-25(16-14-24)30-21-11-8-6-4-2/h13-16,23,29H,3-12,17-22H2,1-2H3