2-(2-methoxyphenyl)-4-(3-methylsulfonylpropoxy)octanoic acid

Systemtic Name: 2-(2-methoxyphenyl)-4-(3-methylsulfonylpropoxy)octanoic acid Openeye Name: 2-(2-methoxyphenyl)-4-(3-methylsulfonylpropoxy)octanoic acid CAS Name: 2-(2-methoxyphenyl)-4-(3-methylsulfonylpropoxy)octanoic acid IUPAC Name: 2-(2-methoxyphenyl)-4-(3-methylsulfonylpropoxy)octanoic acid Traditional Name: 4-(3-mesylpropoxy)-2-(2-methoxyphenyl)caprylic acid Formula: C19H30O6S MolecularWeight: 386.5029

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C1=CC=CC=C1OC)C(=O)O)OCCCS(=O)(=O)C

Isomeric SMILES

CCCCC(CC(C1=CC=CC=C1OC)C(=O)O)OCCCS(=O)(=O)C

InChI

InChI=1S/C19H30O6S/c1-4-5-9-15(25-12-8-13-26(3,22)23)14-17(19(20)21)16-10-6-7-11-18(16)24-2/h6-7,10-11,15,17H,4-5,8-9,12-14H2,1-3H3,(H,20,21)