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

Systemtic Name: (1-butylphenothiazin-10-yl) propane-1-sulfonate Openeye Name: (1-butylphenothiazin-10-yl) propane-1-sulfonate CAS Name: 1-propanesulfonic acid IUPAC Name: (1-butylphenothiazin-10-yl) propane-1-sulfonate Traditional Name: propane-1-sulfonic acid (1-butylphenothiazin-10-yl) ester Formula: C19H23NO3S2 MolecularWeight: 377.52082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(=CC=C1)SC3=CC=CC=C3N2OS(=O)(=O)CCC

Isomeric SMILES

CCCCC1=C2C(=CC=C1)SC3=CC=CC=C3N2OS(=O)(=O)CCC

InChI

InChI=1S/C19H23NO3S2/c1-3-5-9-15-10-8-13-18-19(15)20(23-25(21,22)14-4-2)16-11-6-7-12-17(16)24-18/h6-8,10-13H,3-5,9,14H2,1-2H3