3-(3-cyclopentyloxy-4-methoxy-phenyl)sulfonyl-5-methyl-hexanoic acid

Systemtic Name: 3-(3-cyclopentyloxy-4-methoxy-phenyl)sulfonyl-5-methyl-hexanoic acid Openeye Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]sulfonyl-5-methyl-hexanoic acid CAS Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)sulfonyl-5-methylhexanoic acid IUPAC Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)sulfonyl-5-methylhexanoic acid Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]sulfonyl-5-methyl-hexanoic acid Formula: C19H28O6S MolecularWeight: 384.48702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28O6S/c1-13(2)10-16(12-19(20)21)26(22,23)15-8-9-17(24-3)18(11-15)25-14-6-4-5-7-14/h8-9,11,13-14,16H,4-7,10,12H2,1-3H3,(H,20,21)