2-[(2R)-6-chloranyl-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]-N-(3-piperidin-1-ium-1-ylpropyl)ethanamide

Systemtic Name: 2-[(2R)-6-chloranyl-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]-N-(3-piperidin-1-ium-1-ylpropyl)ethanamide Openeye Name: 2-[(2R)-6-chloro-3-oxo-4H-1,4-benzothiazin-2-yl]-N-(3-piperidin-1-ium-1-ylpropyl)acetamide CAS Name: 2-[(2R)-6-chloro-3-oxo-4H-1,4-benzothiazin-2-yl]-N-[3-(1-piperidin-1-iumyl)propyl]acetamide IUPAC Name: 2-[(2R)-6-chloro-3-oxo-4H-1,4-benzothiazin-2-yl]-N-(3-piperidin-1-ium-1-ylpropyl)acetamide Traditional Name: 2-[(2R)-6-chloro-3-keto-4H-1,4-benzothiazin-2-yl]-N-(3-piperidin-1-ium-1-ylpropyl)acetamide Formula: C18H25ClN3O2S+ MolecularWeight: 382.928

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=O)CC2C(=O)NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=O)C[C@@H]2C(=O)NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C18H24ClN3O2S/c19-13-5-6-15-14(11-13)21-18(24)16(25-15)12-17(23)20-7-4-10-22-8-2-1-3-9-22/h5-6,11,16H,1-4,7-10,12H2,(H,20,23)(H,21,24)/p+1/t16-/m1/s1