methyl hydrogen sulfate; 10H-phenothiazine

Systemtic Name: methyl hydrogen sulfate; 10H-phenothiazine Openeye Name: methyl hydrogen sulfate; 10H-phenothiazine CAS Name: 10H-phenothiazine; sulfuric acid methyl ester IUPAC Name: methyl hydrogen sulfate; 10H-phenothiazine Traditional Name: 10H-phenothiazine; sulfuric acid methyl ester Formula: C13H13NO4S2 MolecularWeight: 311.37662

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)O.C1=CC=C2C(=C1)NC3=CC=CC=C3S2

Isomeric SMILES

COS(=O)(=O)O.C1=CC=C2C(=C1)NC3=CC=CC=C3S2

InChI

InChI=1S/C12H9NS.CH4O4S/c1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11;1-5-6(2,3)4/h1-8,13H;1H3,(H,2,3,4)