heptyl 4-[4-(4-ethoxyphenyl)phenyl]-4-oxidanyl-cyclohexane-1-carboxylate

Systemtic Name: heptyl 4-[4-(4-ethoxyphenyl)phenyl]-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: heptyl 4-[4-(4-ethoxyphenyl)phenyl]-4-hydroxy-cyclohexanecarboxylate CAS Name: 4-[4-(4-ethoxyphenyl)phenyl]-4-hydroxy-1-cyclohexanecarboxylic acid heptyl ester IUPAC Name: heptyl 4-[4-(4-ethoxyphenyl)phenyl]-4-hydroxycyclohexane-1-carboxylate Traditional Name: 4-hydroxy-4-(4-p-phenetylphenyl)cyclohexanecarboxylic acid heptyl ester Formula: C28H38O4 MolecularWeight: 438.59892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1CCC(CC1)(C2=CC=C(C=C2)C3=CC=C(C=C3)OCC)O

Isomeric SMILES

CCCCCCCOC(=O)C1CCC(CC1)(C2=CC=C(C=C2)C3=CC=C(C=C3)OCC)O

InChI

InChI=1S/C28H38O4/c1-3-5-6-7-8-21-32-27(29)24-17-19-28(30,20-18-24)25-13-9-22(10-14-25)23-11-15-26(16-12-23)31-4-2/h9-16,24,30H,3-8,17-21H2,1-2H3