N-[(4-fluorophenyl)methyl]-3-oxidanylidene-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-3-oxidanylidene-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-3-oxo-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-3-oxo-2-(1-piperidin-1-iumyl)-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-3-oxo-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide Traditional Name: N-(4-fluorobenzyl)-3-keto-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazine-6-carboxamide Formula: C21H23FN3O2S+ MolecularWeight: 400.489623

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1CC[NH+](CC1)C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN3O2S/c22-16-7-4-14(5-8-16)13-23-19(26)15-6-9-18-17(12-15)24-20(27)21(28-18)25-10-2-1-3-11-25/h4-9,12,21H,1-3,10-11,13H2,(H,23,26)(H,24,27)/p+1