ethyl sulfate; trimethyl(2-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium

Systemtic Name: ethyl sulfate; trimethyl(2-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium Openeye Name: ethyl sulfate; trimethyl(2-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)ammonium CAS Name: ethyl sulfate; trimethyl-[2-(10-pyrido[3,2-b][1,4]benzothiazinyl)propyl]ammonium IUPAC Name: ethyl sulfate; trimethyl(2-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium Traditional Name: ethyl sulfate; trimethyl(2-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)ammonium Formula: C19H27N3O4S2 MolecularWeight: 425.56538

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)[O-].CC(C[N+](C)(C)C)N1C2=CC=CC=C2SC3=C1N=CC=C3

Isomeric SMILES

CCOS(=O)(=O)[O-].CC(C[N+](C)(C)C)N1C2=CC=CC=C2SC3=C1N=CC=C3

InChI

InChI=1S/C17H22N3S.C2H6O4S/c1-13(12-20(2,3)4)19-14-8-5-6-9-15(14)21-16-10-7-11-18-17(16)19;1-2-6-7(3,4)5/h5-11,13H,12H2,1-4H3;2H2,1H3,(H,3,4,5)/q+1;/p-1