(1,3,6-tripropylphenothiazin-10-yl) propane-1-sulfonate

Systemtic Name: (1,3,6-tripropylphenothiazin-10-yl) propane-1-sulfonate Openeye Name: (1,3,6-tripropylphenothiazin-10-yl) propane-1-sulfonate CAS Name: 1-propanesulfonic acid IUPAC Name: (1,3,6-tripropylphenothiazin-10-yl) propane-1-sulfonate Traditional Name: propane-1-sulfonic acid (1,3,6-tripropylphenothiazin-10-yl) ester Formula: C24H33NO3S2 MolecularWeight: 447.65372

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC=C1)N(C3=C(C=C(C=C3S2)CCC)CCC)OS(=O)(=O)CCC

Isomeric SMILES

CCCC1=C2C(=CC=C1)N(C3=C(C=C(C=C3S2)CCC)CCC)OS(=O)(=O)CCC

InChI

InChI=1S/C24H33NO3S2/c1-5-10-18-16-20(12-7-3)23-22(17-18)29-24-19(11-6-2)13-9-14-21(24)25(23)28-30(26,27)15-8-4/h9,13-14,16-17H,5-8,10-12,15H2,1-4H3