octyl 4-[4-(4-hexoxyphenyl)phenyl]-4-oxidanyl-cyclohexane-1-carboxylate

Systemtic Name: octyl 4-[4-(4-hexoxyphenyl)phenyl]-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: octyl 4-[4-(4-hexoxyphenyl)phenyl]-4-hydroxy-cyclohexanecarboxylate CAS Name: 4-[4-(4-hexoxyphenyl)phenyl]-4-hydroxy-1-cyclohexanecarboxylic acid octyl ester IUPAC Name: octyl 4-[4-(4-hexoxyphenyl)phenyl]-4-hydroxycyclohexane-1-carboxylate Traditional Name: 4-[4-(4-hexoxyphenyl)phenyl]-4-hydroxy-cyclohexanecarboxylic acid octyl ester Formula: C33H48O4 MolecularWeight: 508.73182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1CCC(CC1)(C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCC)O

Isomeric SMILES

CCCCCCCCOC(=O)C1CCC(CC1)(C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCC)O

InChI

InChI=1S/C33H48O4/c1-3-5-7-9-10-12-26-37-32(34)29-21-23-33(35,24-22-29)30-17-13-27(14-18-30)28-15-19-31(20-16-28)36-25-11-8-6-4-2/h13-20,29,35H,3-12,21-26H2,1-2H3