2-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-[(2R)-3-keto-4H-1,4-benzothiazin-2-yl]-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]acetamide Formula: C23H28N3O2S+ MolecularWeight: 410.55232

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)CC3C(=O)NC4=CC=CC=C4S3

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C[C@@H]3C(=O)NC4=CC=CC=C4S3

InChI

InChI=1S/C23H27N3O2S/c27-22(14-21-23(28)25-19-6-2-3-7-20(19)29-21)24-15-17-8-10-18(11-9-17)16-26-12-4-1-5-13-26/h2-3,6-11,21H,1,4-5,12-16H2,(H,24,27)(H,25,28)/p+1/t21-/m1/s1