3-(1-methylpiperidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one

Systemtic Name: 3-(1-methylpiperidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one Openeye Name: 3-(1-methylpiperidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one CAS Name: 3-(1-methyl-1-piperidin-1-iumyl)-1-(10-phenothiazinyl)-1-propanone IUPAC Name: 3-(1-methylpiperidin-1-ium-1-yl)-1-phenothiazin-10-ylpropan-1-one Traditional Name: 3-(1-methylpiperidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one Formula: C21H25N2OS+ MolecularWeight: 353.501

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

C[N+]1(CCCCC1)CCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C21H25N2OS/c1-23(14-7-2-8-15-23)16-13-21(24)22-17-9-3-5-11-19(17)25-20-12-6-4-10-18(20)22/h3-6,9-12H,2,7-8,13-16H2,1H3/q+1