3-(3-cyclopentyloxy-4-methoxy-phenyl)sulfonyloctanoic acid

Systemtic Name: 3-(3-cyclopentyloxy-4-methoxy-phenyl)sulfonyloctanoic acid Openeye Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]sulfonyloctanoic acid CAS Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)sulfonyloctanoic acid IUPAC Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)sulfonyloctanoic acid Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]sulfonylcaprylic acid Formula: C20H30O6S MolecularWeight: 398.5136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)O)S(=O)(=O)C1=CC(=C(C=C1)OC)OC2CCCC2

Isomeric SMILES

CCCCCC(CC(=O)O)S(=O)(=O)C1=CC(=C(C=C1)OC)OC2CCCC2

InChI

InChI=1S/C20H30O6S/c1-3-4-5-10-16(14-20(21)22)27(23,24)17-11-12-18(25-2)19(13-17)26-15-8-6-7-9-15/h11-13,15-16H,3-10,14H2,1-2H3,(H,21,22)