7-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)-5-oxidanyl-3,4-dihydro-2H-1,4-benzothiazine-3-carboxylic acid

Systemtic Name: 7-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)-5-oxidanyl-3,4-dihydro-2H-1,4-benzothiazine-3-carboxylic acid Openeye Name: 7-(2-amino-3-hydroxy-3-oxo-propyl)-5-hydroxy-3,4-dihydro-2H-1,4-benzothiazine-3-carboxylic acid CAS Name: 7-(2-amino-3-hydroxy-3-oxopropyl)-5-hydroxy-3,4-dihydro-2H-1,4-benzothiazine-3-carboxylic acid IUPAC Name: 7-(2-amino-3-hydroxy-3-oxopropyl)-5-hydroxy-3,4-dihydro-2H-1,4-benzothiazine-3-carboxylic acid Traditional Name: 7-(2-amino-3-hydroxy-3-keto-propyl)-5-hydroxy-3,4-dihydro-2H-1,4-benzothiazine-3-carboxylic acid Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC2=C(C=C(C=C2S1)CC(C(=O)O)N)O)C(=O)O

Isomeric SMILES

C1C(NC2=C(C=C(C=C2S1)CC(C(=O)O)N)O)C(=O)O

InChI

InChI=1S/C12H14N2O5S/c13-6(11(16)17)1-5-2-8(15)10-9(3-5)20-4-7(14-10)12(18)19/h2-3,6-7,14-15H,1,4,13H2,(H,16,17)(H,18,19)