6-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbonyl)-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazin-3-one

Systemtic Name: 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbonyl)-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazin-3-one Openeye Name: 6-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazin-3-one CAS Name: 6-[1,4-dioxa-8-azaspiro[4.5]decan-8-yl(oxo)methyl]-2-(1-piperidin-1-iumyl)-4H-1,4-benzothiazin-3-one IUPAC Name: 6-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazin-3-one Traditional Name: 6-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-piperidin-1-ium-1-yl-4H-1,4-benzothiazin-3-one Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)N4CCC5(CC4)OCCO5

Isomeric SMILES

C1CC[NH+](CC1)C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)N4CCC5(CC4)OCCO5

InChI

InChI=1S/C21H27N3O4S/c25-18-20(24-8-2-1-3-9-24)29-17-5-4-15(14-16(17)22-18)19(26)23-10-6-21(7-11-23)27-12-13-28-21/h4-5,14,20H,1-3,6-13H2,(H,22,25)/p+1