[9-(2,2-dimethylpropanoyloxy)-7-(4-methylpiperazin-1-yl)phenoxazin-3-ylidene]-dimethyl-azanium chloride

Systemtic Name: [9-(2,2-dimethylpropanoyloxy)-7-(4-methylpiperazin-1-yl)phenoxazin-3-ylidene]-dimethyl-azanium chloride Openeye Name: [9-(2,2-dimethylpropanoyloxy)-7-(4-methylpiperazin-1-yl)phenoxazin-3-ylidene]-dimethyl-ammonium chloride CAS Name: [9-(2,2-dimethyl-1-oxopropoxy)-7-(4-methyl-1-piperazinyl)-3-phenoxazinylidene]-dimethylammonium chloride IUPAC Name: [9-(2,2-dimethylpropanoyloxy)-7-(4-methylpiperazin-1-yl)phenoxazin-3-ylidene]-dimethylazanium chloride Traditional Name: dimethyl-[7-(4-methylpiperazino)-9-pivaloyloxy-phenoxazin-3-ylidene]ammonium chloride Formula: C24H31ClN4O3 MolecularWeight: 458.98094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=CC(=CC2=C1N=C3C=CC(=[N+](C)C)C=C3O2)N4CCN(CC4)C.[Cl-]

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC(=CC2=C1N=C3C=CC(=[N+](C)C)C=C3O2)N4CCN(CC4)C.[Cl-]

InChI

InChI=1S/C24H31N4O3.ClH/c1-24(2,3)23(29)31-21-15-17(28-11-9-27(6)10-12-28)14-20-22(21)25-18-8-7-16(26(4)5)13-19(18)30-20;/h7-8,13-15H,9-12H2,1-6H3;1H/q+1;/p-1