2-[(3-chlorophenyl)methylidene]-4-methyl-3-oxidanylidene-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1,4-benzothiazine-6-carboxamide

Systemtic Name: 2-[(3-chlorophenyl)methylidene]-4-methyl-3-oxidanylidene-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1,4-benzothiazine-6-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-[(3-chlorophenyl)methylene]-4-methyl-3-oxo-1,4-benzothiazine-6-carboxamide CAS Name: 2-[(3-chlorophenyl)methylidene]-4-methyl-3-oxo-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-1,4-benzothiazine-6-carboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-[(3-chlorophenyl)methylidene]-4-methyl-3-oxo-1,4-benzothiazine-6-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(3-chlorobenzylidene)-3-keto-4-methyl-1,4-benzothiazine-6-carboxamide Formula: C29H29ClN3O2S+ MolecularWeight: 519.07746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4)SC(=CC5=CC(=CC=C5)Cl)C1=O

Isomeric SMILES

CN1C2=C(C=CC(=C2)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4)SC(=CC5=CC(=CC=C5)Cl)C1=O

InChI

InChI=1S/C29H28ClN3O2S/c1-32-25-18-22(10-11-26(25)36-27(29(32)35)17-21-8-5-9-23(30)16-21)28(34)31-24-12-14-33(15-13-24)19-20-6-3-2-4-7-20/h2-11,16-18,24H,12-15,19H2,1H3,(H,31,34)/p+1