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

Systemtic Name: (4-bromanylphenothiazin-10-yl) propane-1-sulfonate Openeye Name: (4-bromophenothiazin-10-yl) propane-1-sulfonate CAS Name: 1-propanesulfonic acid IUPAC Name: (4-bromophenothiazin-10-yl) propane-1-sulfonate Traditional Name: propane-1-sulfonic acid (4-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(=CC=C2)Br)SC3=CC=CC=C31

Isomeric SMILES

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

InChI

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