3-(2-chloranylphenothiazin-10-yl)propyl-trimethyl-azanium bromide

Systemtic Name: 3-(2-chloranylphenothiazin-10-yl)propyl-trimethyl-azanium bromide Openeye Name: 3-(2-chlorophenothiazin-10-yl)propyl-trimethyl-ammonium bromide CAS Name: 3-(2-chloro-10-phenothiazinyl)propyl-trimethylammonium bromide IUPAC Name: 3-(2-chlorophenothiazin-10-yl)propyl-trimethylazanium bromide Traditional Name: 3-(2-chlorophenothiazin-10-yl)propyl-trimethyl-ammonium bromide Formula: C18H22BrClN2S MolecularWeight: 413.80268

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.[Br-]

Isomeric SMILES

C[N+](C)(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.[Br-]

InChI

InChI=1S/C18H22ClN2S.BrH/c1-21(2,3)12-6-11-20-15-7-4-5-8-17(15)22-18-10-9-14(19)13-16(18)20;/h4-5,7-10,13H,6,11-12H2,1-3H3;1H/q+1;/p-1