2-azanyl-3-[4-[1,1-bis(oxidanidyl)-3-oxidanylidene-1,2-thiazolidin-5-yl]phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[4-[1,1-bis(oxidanidyl)-3-oxidanylidene-1,2-thiazolidin-5-yl]phenyl]propanoic acid Openeye Name: 2-amino-3-[4-(1,1-dioxido-3-oxo-1,2-thiazolidin-5-yl)phenyl]propanoic acid CAS Name: 2-amino-3-[4-(1,1-dioxido-3-oxo-1,2-thiazolidin-5-yl)phenyl]propanoic acid IUPAC Name: 2-amino-3-[4-(1,1-dioxido-3-oxo-1,2-thiazolidin-5-yl)phenyl]propanoic acid Traditional Name: 2-amino-3-[4-(3-keto-1,1-dioxido-1,2-thiazolidin-5-yl)phenyl]propionic acid Formula: C12H14N2O5S-2 MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

C1C(S(NC1=O)([O-])[O-])C2=CC=C(C=C2)CC(C(=O)O)N

Isomeric SMILES

C1C(S(NC1=O)([O-])[O-])C2=CC=C(C=C2)CC(C(=O)O)N

InChI

InChI=1S/C12H16N2O5S/c13-9(12(16)17)5-7-1-3-8(4-2-7)10-6-11(15)14-20(10,18)19/h1-4,9-10,18-19H,5-6,13H2,(H,14,15)(H,16,17)/p-2