2-(3-methoxyphenyl)sulfonyloctanoic acid

Systemtic Name: 2-(3-methoxyphenyl)sulfonyloctanoic acid Openeye Name: 2-(3-methoxyphenyl)sulfonyloctanoic acid CAS Name: 2-(3-methoxyphenyl)sulfonyloctanoic acid IUPAC Name: 2-(3-methoxyphenyl)sulfonyloctanoic acid Traditional Name: 2-(3-methoxyphenyl)sulfonylcaprylic acid Formula: C15H22O5S MolecularWeight: 314.39718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22O5S/c1-3-4-5-6-10-14(15(16)17)21(18,19)13-9-7-8-12(11-13)20-2/h7-9,11,14H,3-6,10H2,1-2H3,(H,16,17)