2-[4-methoxy-3-(sulfonylamino)phenyl]-3-(methylaminosulfanyl)-3-oxidanylidene-propanoic acid

Systemtic Name: 2-[4-methoxy-3-(sulfonylamino)phenyl]-3-(methylaminosulfanyl)-3-oxidanylidene-propanoic acid Openeye Name: 2-[4-methoxy-3-(sulfonylamino)phenyl]-3-(methylaminosulfanyl)-3-oxo-propanoic acid CAS Name: 2-[4-methoxy-3-(sulfonylamino)phenyl]-3-(methylaminothio)-3-oxopropanoic acid IUPAC Name: 2-[4-methoxy-3-(sulfonylamino)phenyl]-3-(methylaminosulfanyl)-3-oxopropanoic acid Traditional Name: 3-keto-2-[4-methoxy-3-(sulfonylamino)phenyl]-3-(methylaminothio)propionic acid Formula: C11H12N2O6S2 MolecularWeight: 332.35278

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Descriptors Computed from Structure

Canonical SMILES:

CNSC(=O)C(C1=CC(=C(C=C1)OC)N=S(=O)=O)C(=O)O

Isomeric SMILES

CNSC(=O)C(C1=CC(=C(C=C1)OC)N=S(=O)=O)C(=O)O

InChI

InChI=1S/C11H12N2O6S2/c1-12-20-11(16)9(10(14)15)6-3-4-8(19-2)7(5-6)13-21(17)18/h3-5,9,12H,1-2H3,(H,14,15)