sodium 3-(2-ethanoylphenothiazin-10-yl)propyl sulfate

Systemtic Name: sodium 3-(2-ethanoylphenothiazin-10-yl)propyl sulfate Openeye Name: sodium 3-(2-acetylphenothiazin-10-yl)propyl sulfate CAS Name: sodium 3-(2-acetyl-10-phenothiazinyl)propyl sulfate IUPAC Name: sodium 3-(2-acetylphenothiazin-10-yl)propyl sulfate Traditional Name: sodium 3-(2-acetylphenothiazin-10-yl)propyl sulfate Formula: C17H16NNaO5S2 MolecularWeight: 401.43241

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCOS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCOS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C17H17NO5S2.Na/c1-12(19)13-7-8-17-15(11-13)18(9-4-10-23-25(20,21)22)14-5-2-3-6-16(14)24-17;/h2-3,5-8,11H,4,9-10H2,1H3,(H,20,21,22);/q;+1/p-1