heptyl 4-oxidanyl-4-(4-propoxyphenyl)cyclohexane-1-carboxylate

Systemtic Name: heptyl 4-oxidanyl-4-(4-propoxyphenyl)cyclohexane-1-carboxylate Openeye Name: heptyl 4-hydroxy-4-(4-propoxyphenyl)cyclohexanecarboxylate CAS Name: 4-hydroxy-4-(4-propoxyphenyl)-1-cyclohexanecarboxylic acid heptyl ester IUPAC Name: heptyl 4-hydroxy-4-(4-propoxyphenyl)cyclohexane-1-carboxylate Traditional Name: 4-hydroxy-4-(4-propoxyphenyl)cyclohexanecarboxylic acid heptyl ester Formula: C23H36O4 MolecularWeight: 376.52954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1CCC(CC1)(C2=CC=C(C=C2)OCCC)O

Isomeric SMILES

CCCCCCCOC(=O)C1CCC(CC1)(C2=CC=C(C=C2)OCCC)O

InChI

InChI=1S/C23H36O4/c1-3-5-6-7-8-18-27-22(24)19-13-15-23(25,16-14-19)20-9-11-21(12-10-20)26-17-4-2/h9-12,19,25H,3-8,13-18H2,1-2H3