2-morpholin-4-ium-4-yl-3-oxidanylidene-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: 2-morpholin-4-ium-4-yl-3-oxidanylidene-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4H-1,4-benzothiazine-6-carboxamide Openeye Name: 2-morpholin-4-ium-4-yl-3-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4H-1,4-benzothiazine-6-carboxamide CAS Name: 2-(4-morpholin-4-iumyl)-3-oxo-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: 2-morpholin-4-ium-4-yl-3-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 3-keto-N-[3-(2-ketopyrrolidino)propyl]-2-morpholin-4-ium-4-yl-4H-1,4-benzothiazine-6-carboxamide Formula: C20H27N4O4S+ MolecularWeight: 419.51778

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNC(=O)C2=CC3=C(C=C2)SC(C(=O)N3)[NH+]4CCOCC4

Isomeric SMILES

C1CC(=O)N(C1)CCCNC(=O)C2=CC3=C(C=C2)SC(C(=O)N3)[NH+]4CCOCC4

InChI

InChI=1S/C20H26N4O4S/c25-17-3-1-7-23(17)8-2-6-21-18(26)14-4-5-16-15(13-14)22-19(27)20(29-16)24-9-11-28-12-10-24/h4-5,13,20H,1-3,6-12H2,(H,21,26)(H,22,27)/p+1