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

Systemtic Name: octyl 4-(4-octoxyphenyl)-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: octyl 4-hydroxy-4-(4-octoxyphenyl)cyclohexanecarboxylate CAS Name: 4-hydroxy-4-(4-octoxyphenyl)-1-cyclohexanecarboxylic acid octyl ester IUPAC Name: octyl 4-hydroxy-4-(4-octoxyphenyl)cyclohexane-1-carboxylate Traditional Name: 4-hydroxy-4-(4-octoxyphenyl)cyclohexanecarboxylic acid octyl ester Formula: C29H48O4 MolecularWeight: 460.68902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2(CCC(CC2)C(=O)OCCCCCCCC)O

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2(CCC(CC2)C(=O)OCCCCCCCC)O

InChI

InChI=1S/C29H48O4/c1-3-5-7-9-11-13-23-32-27-17-15-26(16-18-27)29(31)21-19-25(20-22-29)28(30)33-24-14-12-10-8-6-4-2/h15-18,25,31H,3-14,19-24H2,1-2H3