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

Systemtic Name: (3-bromanylphenothiazin-10-yl) propane-1-sulfonate Openeye Name: (3-bromophenothiazin-10-yl) propane-1-sulfonate CAS Name: 1-propanesulfonic acid IUPAC Name: (3-bromophenothiazin-10-yl) propane-1-sulfonate Traditional Name: propane-1-sulfonic acid (3-bromophenothiazin-10-yl) ester Formula: C15H14BrNO3S2 MolecularWeight: 400.31056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14BrNO3S2/c1-2-9-22(18,19)20-17-12-5-3-4-6-14(12)21-15-10-11(16)7-8-13(15)17/h3-8,10H,2,9H2,1H3