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

Systemtic Name: heptyl 4-[4-(4-methoxyphenyl)phenyl]-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: heptyl 4-hydroxy-4-[4-(4-methoxyphenyl)phenyl]cyclohexanecarboxylate CAS Name: 4-hydroxy-4-[4-(4-methoxyphenyl)phenyl]-1-cyclohexanecarboxylic acid heptyl ester IUPAC Name: heptyl 4-hydroxy-4-[4-(4-methoxyphenyl)phenyl]cyclohexane-1-carboxylate Traditional Name: 4-hydroxy-4-[4-(4-methoxyphenyl)phenyl]cyclohexanecarboxylic acid heptyl ester Formula: C27H36O4 MolecularWeight: 424.57234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H36O4/c1-3-4-5-6-7-20-31-26(28)23-16-18-27(29,19-17-23)24-12-8-21(9-13-24)22-10-14-25(30-2)15-11-22/h8-15,23,29H,3-7,16-20H2,1-2H3