3-(2-chloranyl-10-oxidanidyl-5-oxidanylidene-phenothiazin-10-ium-10-yl)-N,N-dimethyl-propan-1-amine

Systemtic Name: 3-(2-chloranyl-10-oxidanidyl-5-oxidanylidene-phenothiazin-10-ium-10-yl)-N,N-dimethyl-propan-1-amine Openeye Name: 3-(2-chloro-10-oxido-5-oxo-phenothiazin-10-ium-10-yl)-N,N-dimethyl-propan-1-amine CAS Name: 3-(2-chloro-10-oxido-5-oxo-10-phenothiazin-10-iumyl)-N,N-dimethyl-1-propanamine IUPAC Name: 3-(2-chloro-10-oxido-5-oxophenothiazin-10-ium-10-yl)-N,N-dimethylpropan-1-amine Traditional Name: 3-(2-chloro-5-keto-10-oxido-phenothiazin-10-ium-10-yl)propyl-dimethyl-amine Formula: C17H19ClN2O2S MolecularWeight: 350.86296

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC[N+]1(C2=CC=CC=C2S(=O)C3=C1C=C(C=C3)Cl)[O-]

Isomeric SMILES

CN(C)CCC[N+]1(C2=CC=CC=C2S(=O)C3=C1C=C(C=C3)Cl)[O-]

InChI

InChI=1S/C17H19ClN2O2S/c1-19(2)10-5-11-20(21)14-6-3-4-7-16(14)23(22)17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3