2-methoxy-2-[4-(3-propylsulfonylpropoxy)phenyl]heptanoic acid

Systemtic Name: 2-methoxy-2-[4-(3-propylsulfonylpropoxy)phenyl]heptanoic acid Openeye Name: 2-methoxy-2-[4-(3-propylsulfonylpropoxy)phenyl]heptanoic acid CAS Name: 2-methoxy-2-[4-(3-propylsulfonylpropoxy)phenyl]heptanoic acid IUPAC Name: 2-methoxy-2-[4-(3-propylsulfonylpropoxy)phenyl]heptanoic acid Traditional Name: 2-methoxy-2-[4-(3-propylsulfonylpropoxy)phenyl]enanthic acid Formula: C20H32O6S MolecularWeight: 400.52948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=C(C=C1)OCCCS(=O)(=O)CCC)(C(=O)O)OC

Isomeric SMILES

CCCCCC(C1=CC=C(C=C1)OCCCS(=O)(=O)CCC)(C(=O)O)OC

InChI

InChI=1S/C20H32O6S/c1-4-6-7-13-20(25-3,19(21)22)17-9-11-18(12-10-17)26-14-8-16-27(23,24)15-5-2/h9-12H,4-8,13-16H2,1-3H3,(H,21,22)