pentyl 4-[4-(4-octoxyphenyl)phenyl]-4-oxidanyl-cyclohexane-1-carboxylate

Systemtic Name: pentyl 4-[4-(4-octoxyphenyl)phenyl]-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: pentyl 4-hydroxy-4-[4-(4-octoxyphenyl)phenyl]cyclohexanecarboxylate CAS Name: 4-hydroxy-4-[4-(4-octoxyphenyl)phenyl]-1-cyclohexanecarboxylic acid pentyl ester IUPAC Name: pentyl 4-hydroxy-4-[4-(4-octoxyphenyl)phenyl]cyclohexane-1-carboxylate Traditional Name: 4-hydroxy-4-[4-(4-octoxyphenyl)phenyl]cyclohexanecarboxylic acid amyl ester Formula: C32H46O4 MolecularWeight: 494.70524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3(CCC(CC3)C(=O)OCCCCC)O

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3(CCC(CC3)C(=O)OCCCCC)O

InChI

InChI=1S/C32H46O4/c1-3-5-7-8-9-11-24-35-30-18-14-27(15-19-30)26-12-16-29(17-13-26)32(34)22-20-28(21-23-32)31(33)36-25-10-6-4-2/h12-19,28,34H,3-11,20-25H2,1-2H3