butyl 4-[4-(4-butoxyphenyl)phenyl]-4-oxidanyl-cyclohexane-1-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3(CCC(CC3)C(=O)OCCCC)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3(CCC(CC3)C(=O)OCCCC)O

InChI

InChI=1S/C27H36O4/c1-3-5-19-30-25-13-9-22(10-14-25)21-7-11-24(12-8-21)27(29)17-15-23(16-18-27)26(28)31-20-6-4-2/h7-14,23,29H,3-6,15-20H2,1-2H3