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

Systemtic Name: 2-[(3-methoxyphenyl)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-methoxyphenyl)methylene]-4-methyl-3-oxo-1,4-benzothiazine-6-carboxamide CAS Name: 2-[(3-methoxyphenyl)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-methoxyphenyl)methylidene]-4-methyl-3-oxo-1,4-benzothiazine-6-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-keto-2-m-anisylidene-4-methyl-1,4-benzothiazine-6-carboxamide Formula: C30H32N3O3S+ MolecularWeight: 514.65838

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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)OC)C1=O

Isomeric SMILES

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

InChI

InChI=1S/C30H31N3O3S/c1-32-26-19-23(29(34)31-24-13-15-33(16-14-24)20-21-7-4-3-5-8-21)11-12-27(26)37-28(30(32)35)18-22-9-6-10-25(17-22)36-2/h3-12,17-19,24H,13-16,20H2,1-2H3,(H,31,34)/p+1