4-cyano-4-[4-methoxy-3-(3-oxidanylcyclopentyl)oxy-phenyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-cyano-4-[4-methoxy-3-(3-oxidanylcyclopentyl)oxy-phenyl]cyclohexane-1-carboxylic acid Openeye Name: 4-cyano-4-[3-(3-hydroxycyclopentoxy)-4-methoxy-phenyl]cyclohexanecarboxylic acid CAS Name: 4-cyano-4-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-cyano-4-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]cyclohexane-1-carboxylic acid Traditional Name: 4-cyano-4-[3-(3-hydroxycyclopentoxy)-4-methoxy-phenyl]cyclohexanecarboxylic acid Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC(CC2)C(=O)O)C#N)OC3CCC(C3)O

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC(CC2)C(=O)O)C#N)OC3CCC(C3)O

InChI

InChI=1S/C20H25NO5/c1-25-17-5-2-14(10-18(17)26-16-4-3-15(22)11-16)20(12-21)8-6-13(7-9-20)19(23)24/h2,5,10,13,15-16,22H,3-4,6-9,11H2,1H3,(H,23,24)