sodium (3Z)-2-methyl-1,1,4-tris(oxidanylidene)-N-pyridin-2-yl-3H-1$l^{6},2-benzothiazine-3-carboximidate

Systemtic Name: sodium (3Z)-2-methyl-1,1,4-tris(oxidanylidene)-N-pyridin-2-yl-3H-1$l^{6},2-benzothiazine-3-carboximidate Openeye Name: sodium (3Z)-2-methyl-1,1,4-trioxo-N-(2-pyridyl)-3H-1$l^{6},2-benzothiazine-3-carboximidate CAS Name: sodium (3Z)-2-methyl-1,1,4-trioxo-N-(2-pyridinyl)-3H-1$l^{6},2-benzothiazine-3-carboximidate IUPAC Name: sodium (3Z)-2-methyl-1,1,4-trioxo-N-pyridin-2-yl-3H-1$l^{6},2-benzothiazine-3-carboximidate Traditional Name: sodium (3Z)-1,1,4-triketo-2-methyl-N-(2-pyridyl)-3H-1$l^{6},2-benzothiazine-3-carboximidate Formula: C15H12N3NaO4S MolecularWeight: 353.32825

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(=O)C2=CC=CC=C2S1(=O)=O)C(=NC3=CC=CC=N3)[O-].[Na+]

Isomeric SMILES

CN1C(C(=O)C2=CC=CC=C2S1(=O)=O)/C(=N/C3=CC=CC=N3)/[O-].[Na+]

InChI

InChI=1S/C15H13N3O4S.Na/c1-18-13(15(20)17-12-8-4-5-9-16-12)14(19)10-6-2-3-7-11(10)23(18,21)22;/h2-9,13H,1H3,(H,16,17,20);/q;+1/p-1