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2-(2-methoxyphenyl)sulfonyl-2-propyl-propanedioic acid

2-(2-methoxyphenyl)sulfonyl-2-propyl-propanedioic acid

Systemtic Name:2-(2-methoxyphenyl)sulfonyl-2-propyl-propanedioic acid
Openeye Name:2-(2-methoxyphenyl)sulfonyl-2-propyl-propanedioic acid
CAS Name:2-(2-methoxyphenyl)sulfonyl-2-propylpropanedioic acid
IUPAC Name:2-(2-methoxyphenyl)sulfonyl-2-propylpropanedioic acid
Traditional Name:2-(2-methoxyphenyl)sulfonyl-2-propyl-malonic acid
Formula: C13H16O7S
MolecularWeight: 316.32694
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)(C(=O)O)S(=O)(=O)C1=CC=CC=C1OC


Isomeric SMILES

CCCC(C(=O)O)(C(=O)O)S(=O)(=O)C1=CC=CC=C1OC


InChI

InChI=1S/C13H16O7S/c1-3-8-13(11(14)15,12(16)17)21(18,19)10-7-5-4-6-9(10)20-2/h4-7H,3,8H2,1-2H3,(H,14,15)(H,16,17)


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