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

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

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

Canonical SMILES:

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


Isomeric SMILES

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


InChI

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


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