N-(3-methoxypropyl)-2-morpholin-4-ium-4-yl-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-(3-methoxypropyl)-2-morpholin-4-ium-4-yl-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-(3-methoxypropyl)-2-morpholin-4-ium-4-yl-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-(3-methoxypropyl)-2-(4-morpholin-4-iumyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-(3-methoxypropyl)-2-morpholin-4-ium-4-yl-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 3-keto-N-(3-methoxypropyl)-2-morpholin-4-ium-4-yl-4H-1,4-benzothiazine-6-carboxamide Formula: C17H24N3O4S+ MolecularWeight: 366.45516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O4S/c1-23-8-2-5-18-15(21)12-3-4-14-13(11-12)19-16(22)17(25-14)20-6-9-24-10-7-20/h3-4,11,17H,2,5-10H2,1H3,(H,18,21)(H,19,22)/p+1