(2,4-dimethylphenothiazin-10-yl) propane-1-sulfonate

Systemtic Name: (2,4-dimethylphenothiazin-10-yl) propane-1-sulfonate Openeye Name: (2,4-dimethylphenothiazin-10-yl) propane-1-sulfonate CAS Name: 1-propanesulfonic acid IUPAC Name: (2,4-dimethylphenothiazin-10-yl) propane-1-sulfonate Traditional Name: propane-1-sulfonic acid (2,4-dimethylphenothiazin-10-yl) ester Formula: C17H19NO3S2 MolecularWeight: 349.46766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)ON1C2=CC=CC=C2SC3=C(C=C(C=C31)C)C

Isomeric SMILES

CCCS(=O)(=O)ON1C2=CC=CC=C2SC3=C(C=C(C=C31)C)C

InChI

InChI=1S/C17H19NO3S2/c1-4-9-23(19,20)21-18-14-7-5-6-8-16(14)22-17-13(3)10-12(2)11-15(17)18/h5-8,10-11H,4,9H2,1-3H3