octyl 2-oxidanyl-2-(4-phenylphenyl)cyclohexane-1-carboxylate

Systemtic Name: octyl 2-oxidanyl-2-(4-phenylphenyl)cyclohexane-1-carboxylate Openeye Name: octyl 2-hydroxy-2-(4-phenylphenyl)cyclohexanecarboxylate CAS Name: 2-hydroxy-2-(4-phenylphenyl)-1-cyclohexanecarboxylic acid octyl ester IUPAC Name: octyl 2-hydroxy-2-(4-phenylphenyl)cyclohexane-1-carboxylate Traditional Name: 2-hydroxy-2-(4-phenylphenyl)cyclohexanecarboxylic acid octyl ester Formula: C27H36O3 MolecularWeight: 408.57294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1CCCCC1(C2=CC=C(C=C2)C3=CC=CC=C3)O

Isomeric SMILES

CCCCCCCCOC(=O)C1CCCCC1(C2=CC=C(C=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C27H36O3/c1-2-3-4-5-6-12-21-30-26(28)25-15-10-11-20-27(25,29)24-18-16-23(17-19-24)22-13-8-7-9-14-22/h7-9,13-14,16-19,25,29H,2-6,10-12,15,20-21H2,1H3