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

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-oxidanylidene-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-oxo-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-3-oxo-2-(1-piperidin-1-iumyl)-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-oxo-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 3-keto-N-(3-morpholin-4-ium-4-ylpropyl)-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide Formula: C21H32N4O3S+2 MolecularWeight: 420.56878

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)NCCC[NH+]4CCOCC4

Isomeric SMILES

C1CC[NH+](CC1)C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C21H30N4O3S/c26-19(22-7-4-8-24-11-13-28-14-12-24)16-5-6-18-17(15-16)23-20(27)21(29-18)25-9-2-1-3-10-25/h5-6,15,21H,1-4,7-14H2,(H,22,26)(H,23,27)/p+2