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

Systemtic Name: 3-(2-ethanoylphenothiazin-10-yl)propyl hydrogen sulfate Openeye Name: 3-(2-acetylphenothiazin-10-yl)propyl hydrogen sulfate CAS Name: sulfuric acid 3-(2-acetyl-10-phenothiazinyl)propyl ester IUPAC Name: 3-(2-acetylphenothiazin-10-yl)propyl hydrogen sulfate Traditional Name: sulfuric acid 3-(2-acetylphenothiazin-10-yl)propyl ester Formula: C17H17NO5S2 MolecularWeight: 379.45058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCOS(=O)(=O)O

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCOS(=O)(=O)O

InChI

InChI=1S/C17H17NO5S2/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)