1-[3,5-dimethyl-7-nitro-1,1-bis(oxidanylidene)-4H-1$l^{6},4-benzothiazin-2-yl]ethanone

Systemtic Name: 1-[3,5-dimethyl-7-nitro-1,1-bis(oxidanylidene)-4H-1$l^{6},4-benzothiazin-2-yl]ethanone Openeye Name: 1-(3,5-dimethyl-7-nitro-1,1-dioxo-4H-1$l^{6},4-benzothiazin-2-yl)ethanone CAS Name: 1-(3,5-dimethyl-7-nitro-1,1-dioxo-4H-1$l^{6},4-benzothiazin-2-yl)ethanone IUPAC Name: 1-(3,5-dimethyl-7-nitro-1,1-dioxo-4H-1$l^{6},4-benzothiazin-2-yl)ethanone Traditional Name: 1-(1,1-diketo-3,5-dimethyl-7-nitro-4H-1$l^{6},4-benzothiazin-2-yl)ethanone Formula: C12H12N2O5S MolecularWeight: 296.29908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1NC(=C(S2(=O)=O)C(=O)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC2=C1NC(=C(S2(=O)=O)C(=O)C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H12N2O5S/c1-6-4-9(14(16)17)5-10-11(6)13-7(2)12(8(3)15)20(10,18)19/h4-5,13H,1-3H3