methyl-(3-oxidanylidene-3-phenothiazin-10-yl-propyl)-dipropyl-azanium

Systemtic Name: methyl-(3-oxidanylidene-3-phenothiazin-10-yl-propyl)-dipropyl-azanium Openeye Name: methyl-(3-oxo-3-phenothiazin-10-yl-propyl)-dipropyl-ammonium CAS Name: methyl-[3-oxo-3-(10-phenothiazinyl)propyl]-dipropylammonium IUPAC Name: methyl-(3-oxo-3-phenothiazin-10-ylpropyl)-dipropylazanium Traditional Name: (3-keto-3-phenothiazin-10-yl-propyl)-methyl-dipropyl-ammonium Formula: C22H29N2OS+ MolecularWeight: 369.54346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C)(CCC)CCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31

Isomeric SMILES

CCC[N+](C)(CCC)CCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31

InChI

InChI=1S/C22H29N2OS/c1-4-15-24(3,16-5-2)17-14-22(25)23-18-10-6-8-12-20(18)26-21-13-9-7-11-19(21)23/h6-13H,4-5,14-17H2,1-3H3/q+1