[7-(dimethylamino)-4-nitro-phenothiazin-3-ylidene]-dimethyl-azanium

Systemtic Name: [7-(dimethylamino)-4-nitro-phenothiazin-3-ylidene]-dimethyl-azanium Openeye Name: [7-(dimethylamino)-4-nitro-phenothiazin-3-ylidene]-dimethyl-ammonium CAS Name: [7-(dimethylamino)-4-nitro-3-phenothiazinylidene]-dimethylammonium IUPAC Name: [7-(dimethylamino)-4-nitrophenothiazin-3-ylidene]-dimethylazanium Traditional Name: [7-(dimethylamino)-4-nitro-phenothiazin-3-ylidene]-dimethyl-ammonium Formula: C16H17N4O2S+ MolecularWeight: 329.39678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C(=C3S2)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C(=C3S2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N4O2S/c1-18(2)10-5-6-11-14(9-10)23-16-12(17-11)7-8-13(19(3)4)15(16)20(21)22/h5-9H,1-4H3/q+1