1-chloranyl-6-cyano-6-(3-cyclopentyloxy-4-methoxy-phenyl)-2-oxaspiro[2.5]octane-1-carboxylic acid

Systemtic Name: 1-chloranyl-6-cyano-6-(3-cyclopentyloxy-4-methoxy-phenyl)-2-oxaspiro[2.5]octane-1-carboxylic acid Openeye Name: 1-chloro-6-cyano-6-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-oxaspiro[2.5]octane-1-carboxylic acid CAS Name: 1-chloro-6-cyano-6-(3-cyclopentyloxy-4-methoxyphenyl)-2-oxaspiro[2.5]octane-1-carboxylic acid IUPAC Name: 1-chloro-6-cyano-6-(3-cyclopentyloxy-4-methoxyphenyl)-2-oxaspiro[2.5]octane-1-carboxylic acid Traditional Name: 1-chloro-6-cyano-6-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-oxaspiro[2.5]octane-1-carboxylic acid Formula: C21H24ClNO5 MolecularWeight: 405.87196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC3(CC2)C(O3)(C(=O)O)Cl)C#N)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC3(CC2)C(O3)(C(=O)O)Cl)C#N)OC4CCCC4

InChI

InChI=1S/C21H24ClNO5/c1-26-16-7-6-14(12-17(16)27-15-4-2-3-5-15)19(13-23)8-10-20(11-9-19)21(22,28-20)18(24)25/h6-7,12,15H,2-5,8-11H2,1H3,(H,24,25)