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

Systemtic Name: 2-[(3-methoxyphenyl)methylidene]-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: 2-[(3-methoxyphenyl)methylene]-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: 2-[(3-methoxyphenyl)methylidene]-N-[2-(2-methyl-1-piperidin-1-iumyl)ethyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: 2-[(3-methoxyphenyl)methylidene]-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 3-keto-2-m-anisylidene-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-4H-1,4-benzothiazine-6-carboxamide Formula: C25H30N3O3S+ MolecularWeight: 452.589

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCNC(=O)C2=CC3=C(C=C2)SC(=CC4=CC(=CC=C4)OC)C(=O)N3

Isomeric SMILES

CC1CCCC[NH+]1CCNC(=O)C2=CC3=C(C=C2)SC(=CC4=CC(=CC=C4)OC)C(=O)N3

InChI

InChI=1S/C25H29N3O3S/c1-17-6-3-4-12-28(17)13-11-26-24(29)19-9-10-22-21(16-19)27-25(30)23(32-22)15-18-7-5-8-20(14-18)31-2/h5,7-10,14-17H,3-4,6,11-13H2,1-2H3,(H,26,29)(H,27,30)/p+1