4-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)cyclohexene-1-carboxylic acid

Systemtic Name: 4-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)cyclohexene-1-carboxylic acid Openeye Name: 4-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]cyclohexene-1-carboxylic acid CAS Name: 4-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)-1-cyclohexenecarboxylic acid IUPAC Name: 4-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexene-1-carboxylic acid Traditional Name: 4-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]cyclohexene-1-carboxylic acid Formula: C20H23NO4 MolecularWeight: 341.40092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC(=CC2)C(=O)O)C#N)OC3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC(=CC2)C(=O)O)C#N)OC3CCCC3

InChI

InChI=1S/C20H23NO4/c1-24-17-7-6-15(12-18(17)25-16-4-2-3-5-16)20(13-21)10-8-14(9-11-20)19(22)23/h6-8,12,16H,2-5,9-11H2,1H3,(H,22,23)