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

Systemtic Name: [3,5-dimethyl-7-nitro-1,1-bis(oxidanylidene)-4H-1$l^{6},4-benzothiazin-2-yl]-phenyl-methanone Openeye Name: (3,5-dimethyl-7-nitro-1,1-dioxo-4H-1$l^{6},4-benzothiazin-2-yl)-phenyl-methanone CAS Name: (3,5-dimethyl-7-nitro-1,1-dioxo-4H-1$l^{6},4-benzothiazin-2-yl)-phenylmethanone IUPAC Name: (3,5-dimethyl-7-nitro-1,1-dioxo-4H-1$l^{6},4-benzothiazin-2-yl)-phenylmethanone Traditional Name: (1,1-diketo-3,5-dimethyl-7-nitro-4H-1$l^{6},4-benzothiazin-2-yl)-phenyl-methanone Formula: C17H14N2O5S MolecularWeight: 358.36846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1NC(=C(S2(=O)=O)C(=O)C3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC2=C1NC(=C(S2(=O)=O)C(=O)C3=CC=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O5S/c1-10-8-13(19(21)22)9-14-15(10)18-11(2)17(25(14,23)24)16(20)12-6-4-3-5-7-12/h3-9,18H,1-2H3