ethyl-dimethyl-(1-phenothiazin-10-ylpropan-2-yl)azanium; ethyl sulfate

Systemtic Name: ethyl-dimethyl-(1-phenothiazin-10-ylpropan-2-yl)azanium; ethyl sulfate Openeye Name: ethyl-dimethyl-(1-methyl-2-phenothiazin-10-yl-ethyl)ammonium; ethyl sulfate CAS Name: ethyl-dimethyl-[1-(10-phenothiazinyl)propan-2-yl]ammonium; ethyl sulfate IUPAC Name: ethyl-dimethyl-(1-phenothiazin-10-ylpropan-2-yl)azanium; ethyl sulfate Traditional Name: ethyl-dimethyl-(1-methyl-2-phenothiazin-10-yl-ethyl)ammonium; ethyl sulfate Formula: C21H30N2O4S2 MolecularWeight: 438.6039

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(C)C(C)CN1C2=CC=CC=C2SC3=CC=CC=C31.CCOS(=O)(=O)[O-]

Isomeric SMILES

CC[N+](C)(C)C(C)CN1C2=CC=CC=C2SC3=CC=CC=C31.CCOS(=O)(=O)[O-]

InChI

InChI=1S/C19H25N2S.C2H6O4S/c1-5-21(3,4)15(2)14-20-16-10-6-8-12-18(16)22-19-13-9-7-11-17(19)20;1-2-6-7(3,4)5/h6-13,15H,5,14H2,1-4H3;2H2,1H3,(H,3,4,5)/q+1;/p-1