N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCNC(=O)C2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

CC1CCCC[NH+]1CCNC(=O)C2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C17H23N3O2S/c1-12-4-2-3-8-20(12)9-7-18-17(22)13-5-6-15-14(10-13)19-16(21)11-23-15/h5-6,10,12H,2-4,7-9,11H2,1H3,(H,18,22)(H,19,21)/p+1