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3-(ethanethioylamino)-5-methoxycarbonyl-benzoic acid

3-(ethanethioylamino)-5-methoxycarbonyl-benzoic acid

Systemtic Name:3-(ethanethioylamino)-5-methoxycarbonyl-benzoic acid
Openeye Name:3-(ethanethioylamino)-5-methoxycarbonyl-benzoic acid
CAS Name:3-methoxycarbonyl-5-(1-sulfanylideneethylamino)benzoic acid
IUPAC Name:3-(ethanethioylamino)-5-methoxycarbonylbenzoic acid
Traditional Name:3-carbomethoxy-5-(thioacetylamino)benzoic acid
Formula: C11H11NO4S
MolecularWeight: 253.27434
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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NC1=CC(=CC(=C1)C(=O)OC)C(=O)O


Isomeric SMILES

CC(=S)NC1=CC(=CC(=C1)C(=O)OC)C(=O)O


InChI

InChI=1S/C11H11NO4S/c1-6(17)12-9-4-7(10(13)14)3-8(5-9)11(15)16-2/h3-5H,1-2H3,(H,12,17)(H,13,14)


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