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2-ethoxycarbonyl-4-methylsulfonyl-benzoic acid

2-ethoxycarbonyl-4-methylsulfonyl-benzoic acid

Systemtic Name:2-ethoxycarbonyl-4-methylsulfonyl-benzoic acid
Openeye Name:2-ethoxycarbonyl-4-methylsulfonyl-benzoic acid
CAS Name:2-ethoxycarbonyl-4-methylsulfonylbenzoic acid
IUPAC Name:2-ethoxycarbonyl-4-methylsulfonylbenzoic acid
Traditional Name:2-carbethoxy-4-mesyl-benzoic acid
Formula: C11H12O6S
MolecularWeight: 272.27438
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C11H12O6S/c1-3-17-11(14)9-6-7(18(2,15)16)4-5-8(9)10(12)13/h4-6H,3H2,1-2H3,(H,12,13)


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