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

Systemtic Name: heptyl 4-(4-ethoxyphenyl)-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: heptyl 4-(4-ethoxyphenyl)-4-hydroxy-cyclohexanecarboxylate CAS Name: 4-(4-ethoxyphenyl)-4-hydroxy-1-cyclohexanecarboxylic acid heptyl ester IUPAC Name: heptyl 4-(4-ethoxyphenyl)-4-hydroxycyclohexane-1-carboxylate Traditional Name: 4-hydroxy-4-p-phenetyl-cyclohexanecarboxylic acid heptyl ester Formula: C22H34O4 MolecularWeight: 362.50296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H34O4/c1-3-5-6-7-8-17-26-21(23)18-13-15-22(24,16-14-18)19-9-11-20(12-10-19)25-4-2/h9-12,18,24H,3-8,13-17H2,1-2H3