4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-3-oxidanylidene-1,4-benzothiazine-6-carboxamide

Systemtic Name: 4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-3-oxidanylidene-1,4-benzothiazine-6-carboxamide Openeye Name: 4-[(2-chloro-6-fluoro-phenyl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-3-oxo-1,4-benzothiazine-6-carboxamide CAS Name: 4-[(2-chloro-6-fluorophenyl)methyl]-N-[2-(4-morpholin-4-iumyl)ethyl]-3-oxo-1,4-benzothiazine-6-carboxamide IUPAC Name: 4-[(2-chloro-6-fluorophenyl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-3-oxo-1,4-benzothiazine-6-carboxamide Traditional Name: 4-(2-chloro-6-fluoro-benzyl)-3-keto-N-(2-morpholin-4-ium-4-ylethyl)-1,4-benzothiazine-6-carboxamide Formula: C22H24ClFN3O3S+ MolecularWeight: 464.960663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=CC3=C(C=C2)SCC(=O)N3CC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=CC3=C(C=C2)SCC(=O)N3CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C22H23ClFN3O3S/c23-17-2-1-3-18(24)16(17)13-27-19-12-15(4-5-20(19)31-14-21(27)28)22(29)25-6-7-26-8-10-30-11-9-26/h1-5,12H,6-11,13-14H2,(H,25,29)/p+1