(3-ethylphenothiazin-10-yl) propane-1-sulfonate

Systemtic Name: (3-ethylphenothiazin-10-yl) propane-1-sulfonate Openeye Name: (3-ethylphenothiazin-10-yl) propane-1-sulfonate CAS Name: 1-propanesulfonic acid IUPAC Name: (3-ethylphenothiazin-10-yl) propane-1-sulfonate Traditional Name: propane-1-sulfonic acid (3-ethylphenothiazin-10-yl) ester Formula: C17H19NO3S2 MolecularWeight: 349.46766

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)ON1C2=C(C=C(C=C2)CC)SC3=CC=CC=C31

Isomeric SMILES

CCCS(=O)(=O)ON1C2=C(C=C(C=C2)CC)SC3=CC=CC=C31

InChI

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