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2-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylbutanedioic acid

2-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylbutanedioic acid

Systemtic Name:2-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylbutanedioic acid
Openeye Name:2-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylbutanedioic acid
CAS Name:2-(4-methoxy-2,3,6-trimethylphenyl)sulfonylbutanedioic acid
IUPAC Name:2-(4-methoxy-2,3,6-trimethylphenyl)sulfonylbutanedioic acid
Traditional Name:2-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylsuccinic acid
Formula: C14H18O7S
MolecularWeight: 330.35352
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)C(CC(=O)O)C(=O)O)C)C)OC


Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)C(CC(=O)O)C(=O)O)C)C)OC


InChI

InChI=1S/C14H18O7S/c1-7-5-10(21-4)8(2)9(3)13(7)22(19,20)11(14(17)18)6-12(15)16/h5,11H,6H2,1-4H3,(H,15,16)(H,17,18)


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