N-(3-morpholin-4-ium-4-ylpropyl)-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-1,1-dioxo-1,2-benzothiazol-3-amine CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-1,1-dioxo-1,2-benzothiazol-3-amine IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-1,1-dioxo-1,2-benzothiazol-3-amine Traditional Name: (1,1-diketo-1,2-benzothiazol-3-yl)-(3-morpholin-4-ium-4-ylpropyl)amine Formula: C14H20N3O3S+ MolecularWeight: 310.3919

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

C1COCC[NH+]1CCCNC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C14H19N3O3S/c18-21(19)13-5-2-1-4-12(13)14(16-21)15-6-3-7-17-8-10-20-11-9-17/h1-2,4-5H,3,6-11H2,(H,15,16)/p+1