(1-methylphenothiazin-10-yl) propane-1-sulfonate

Systemtic Name: (1-methylphenothiazin-10-yl) propane-1-sulfonate Openeye Name: (1-methylphenothiazin-10-yl) propane-1-sulfonate CAS Name: 1-propanesulfonic acid IUPAC Name: (1-methylphenothiazin-10-yl) propane-1-sulfonate Traditional Name: propane-1-sulfonic acid (1-methylphenothiazin-10-yl) ester Formula: C16H17NO3S2 MolecularWeight: 335.44108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO3S2/c1-3-11-22(18,19)20-17-13-8-4-5-9-14(13)21-15-10-6-7-12(2)16(15)17/h4-10H,3,11H2,1-2H3