3-(4-azanylsulfanylphenoxy)-4,4-bis(oxidanyl)-2-oxidanylidene-but-3-enoic acid

Systemtic Name: 3-(4-azanylsulfanylphenoxy)-4,4-bis(oxidanyl)-2-oxidanylidene-but-3-enoic acid Openeye Name: 3-(4-aminosulfanylphenoxy)-4,4-dihydroxy-2-oxo-but-3-enoic acid CAS Name: 3-[4-(aminothio)phenoxy]-4,4-dihydroxy-2-oxo-3-butenoic acid IUPAC Name: 3-(4-aminosulfanylphenoxy)-4,4-dihydroxy-2-oxobut-3-enoic acid Traditional Name: 3-[4-(aminothio)phenoxy]-4,4-dihydroxy-2-keto-but-3-enoic acid Formula: C10H9NO6S MolecularWeight: 271.24656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC(=C(O)O)C(=O)C(=O)O)SN

Isomeric SMILES

C1=CC(=CC=C1OC(=C(O)O)C(=O)C(=O)O)SN

InChI

InChI=1S/C10H9NO6S/c11-18-6-3-1-5(2-4-6)17-8(10(15)16)7(12)9(13)14/h1-4,15-16H,11H2,(H,13,14)