dimethyl-(1-phenothiazin-10-ylpropan-2-yl)-propyl-azanium iodide

Systemtic Name: dimethyl-(1-phenothiazin-10-ylpropan-2-yl)-propyl-azanium iodide Openeye Name: dimethyl-(1-methyl-2-phenothiazin-10-yl-ethyl)-propyl-ammonium iodide CAS Name: dimethyl-[1-(10-phenothiazinyl)propan-2-yl]-propylammonium iodide IUPAC Name: dimethyl-(1-phenothiazin-10-ylpropan-2-yl)-propylazanium iodide Traditional Name: dimethyl-(1-methyl-2-phenothiazin-10-yl-ethyl)-propyl-ammonium iodide Formula: C20H27IN2S MolecularWeight: 454.41125

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C)(C)C(C)CN1C2=CC=CC=C2SC3=CC=CC=C31.[I-]

Isomeric SMILES

CCC[N+](C)(C)C(C)CN1C2=CC=CC=C2SC3=CC=CC=C31.[I-]

InChI

InChI=1S/C20H27N2S.HI/c1-5-14-22(3,4)16(2)15-21-17-10-6-8-12-19(17)23-20-13-9-7-11-18(20)21;/h6-13,16H,5,14-15H2,1-4H3;1H/q+1;/p-1