2-(1-methylpiperidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one

Systemtic Name: 2-(1-methylpiperidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one Openeye Name: 2-(1-methylpiperidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one CAS Name: 2-(1-methyl-1-piperidin-1-iumyl)-1-(10-phenothiazinyl)-1-propanone IUPAC Name: 2-(1-methylpiperidin-1-ium-1-yl)-1-phenothiazin-10-ylpropan-1-one Traditional Name: 2-(1-methylpiperidin-1-ium-1-yl)-1-phenothiazin-10-yl-propan-1-one Formula: C21H25N2OS+ MolecularWeight: 353.501

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)[N+]4(CCCCC4)C

Isomeric SMILES

CC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)[N+]4(CCCCC4)C

InChI

InChI=1S/C21H25N2OS/c1-16(23(2)14-8-3-9-15-23)21(24)22-17-10-4-6-12-19(17)25-20-13-7-5-11-18(20)22/h4-7,10-13,16H,3,8-9,14-15H2,1-2H3/q+1