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2-ethyl-2-(3-sulfophenyl)propanedioic acid

2-ethyl-2-(3-sulfophenyl)propanedioic acid

Systemtic Name:2-ethyl-2-(3-sulfophenyl)propanedioic acid
Openeye Name:2-ethyl-2-(3-sulfophenyl)propanedioic acid
CAS Name:2-ethyl-2-(3-sulfophenyl)propanedioic acid
IUPAC Name:2-ethyl-2-(3-sulfophenyl)propanedioic acid
Traditional Name:2-ethyl-2-(3-sulfophenyl)malonic acid
Formula: C11H12O7S
MolecularWeight: 288.27378
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)S(=O)(=O)O)(C(=O)O)C(=O)O


Isomeric SMILES

CCC(C1=CC(=CC=C1)S(=O)(=O)O)(C(=O)O)C(=O)O


InChI

InChI=1S/C11H12O7S/c1-2-11(9(12)13,10(14)15)7-4-3-5-8(6-7)19(16,17)18/h3-6H,2H2,1H3,(H,12,13)(H,14,15)(H,16,17,18)


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