3-oxidanylidene-2-piperidin-1-ium-1-yl-N-propan-2-yl-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: 3-oxidanylidene-2-piperidin-1-ium-1-yl-N-propan-2-yl-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-isopropyl-3-oxo-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide CAS Name: 3-oxo-2-(1-piperidin-1-iumyl)-N-propan-2-yl-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: 3-oxo-2-piperidin-1-ium-1-yl-N-propan-2-yl-4H-1,4-benzothiazine-6-carboxamide Traditional Name: N-isopropyl-3-keto-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide Formula: C17H24N3O2S+ MolecularWeight: 334.45636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC2=C(C=C1)SC(C(=O)N2)[NH+]3CCCCC3

Isomeric SMILES

CC(C)NC(=O)C1=CC2=C(C=C1)SC(C(=O)N2)[NH+]3CCCCC3

InChI

InChI=1S/C17H23N3O2S/c1-11(2)18-15(21)12-6-7-14-13(10-12)19-16(22)17(23-14)20-8-4-3-5-9-20/h6-7,10-11,17H,3-5,8-9H2,1-2H3,(H,18,21)(H,19,22)/p+1