methyl 4-[4-[4-[1-(3-oxidanylidenepropyl)cyclohexyl]phenyl]phenyl]cyclohexane-1-carboxylate

Systemtic Name: methyl 4-[4-[4-[1-(3-oxidanylidenepropyl)cyclohexyl]phenyl]phenyl]cyclohexane-1-carboxylate Openeye Name: methyl 4-[4-[4-[1-(3-oxopropyl)cyclohexyl]phenyl]phenyl]cyclohexanecarboxylate CAS Name: 4-[4-[4-[1-(3-oxopropyl)cyclohexyl]phenyl]phenyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-[4-[1-(3-oxopropyl)cyclohexyl]phenyl]phenyl]cyclohexane-1-carboxylate Traditional Name: 4-[4-[4-[1-(3-ketopropyl)cyclohexyl]phenyl]phenyl]cyclohexanecarboxylic acid methyl ester Formula: C29H36O3 MolecularWeight: 432.59434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4(CCCCC4)CCC=O

Isomeric SMILES

COC(=O)C1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4(CCCCC4)CCC=O

InChI

InChI=1S/C29H36O3/c1-32-28(31)26-12-10-24(11-13-26)22-6-8-23(9-7-22)25-14-16-27(17-15-25)29(20-5-21-30)18-3-2-4-19-29/h6-9,14-17,21,24,26H,2-5,10-13,18-20H2,1H3