3-(3,4-dimethoxyphenyl)sulfonyl-2-ethyl-hexanoic acid

Systemtic Name: 3-(3,4-dimethoxyphenyl)sulfonyl-2-ethyl-hexanoic acid Openeye Name: 3-(3,4-dimethoxyphenyl)sulfonyl-2-ethyl-hexanoic acid CAS Name: 3-(3,4-dimethoxyphenyl)sulfonyl-2-ethylhexanoic acid IUPAC Name: 3-(3,4-dimethoxyphenyl)sulfonyl-2-ethylhexanoic acid Traditional Name: 3-(3,4-dimethoxyphenyl)sulfonyl-2-ethyl-hexanoic acid Formula: C16H24O6S MolecularWeight: 344.42316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24O6S/c1-5-7-15(12(6-2)16(17)18)23(19,20)11-8-9-13(21-3)14(10-11)22-4/h8-10,12,15H,5-7H2,1-4H3,(H,17,18)