N,N-diethyl-2-morpholin-4-ium-4-yl-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N,N-diethyl-2-morpholin-4-ium-4-yl-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N,N-diethyl-2-morpholin-4-ium-4-yl-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N,N-diethyl-2-(4-morpholin-4-iumyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N,N-diethyl-2-morpholin-4-ium-4-yl-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: N,N-diethyl-3-keto-2-morpholin-4-ium-4-yl-4H-1,4-benzothiazine-6-carboxamide Formula: C17H24N3O3S+ MolecularWeight: 350.45576

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=C(C=C1)SC(C(=O)N2)[NH+]3CCOCC3

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)SC(C(=O)N2)[NH+]3CCOCC3

InChI

InChI=1S/C17H23N3O3S/c1-3-19(4-2)16(22)12-5-6-14-13(11-12)18-15(21)17(24-14)20-7-9-23-10-8-20/h5-6,11,17H,3-4,7-10H2,1-2H3,(H,18,21)/p+1