2-[3,3-dimethyl-6-methylsulfonyl-2,2-bis(oxidanylidene)-4H-2$l^{6},1-benzothiazin-1-yl]ethanal

Systemtic Name: 2-[3,3-dimethyl-6-methylsulfonyl-2,2-bis(oxidanylidene)-4H-2$l^{6},1-benzothiazin-1-yl]ethanal Openeye Name: 2-(3,3-dimethyl-6-methylsulfonyl-2,2-dioxo-4H-2$l^{6},1-benzothiazin-1-yl)acetaldehyde CAS Name: 2-(3,3-dimethyl-6-methylsulfonyl-2,2-dioxo-4H-2$l^{6},1-benzothiazin-1-yl)acetaldehyde IUPAC Name: 2-(3,3-dimethyl-6-methylsulfonyl-2,2-dioxo-4H-2$l^{6},1-benzothiazin-1-yl)acetaldehyde Traditional Name: 2-(2,2-diketo-6-mesyl-3,3-dimethyl-4H-2$l^{6},1-benzothiazin-1-yl)acetaldehyde Formula: C13H17NO5S2 MolecularWeight: 331.40778

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC(=C2)S(=O)(=O)C)N(S1(=O)=O)CC=O)C

Isomeric SMILES

CC1(CC2=C(C=CC(=C2)S(=O)(=O)C)N(S1(=O)=O)CC=O)C

InChI

InChI=1S/C13H17NO5S2/c1-13(2)9-10-8-11(20(3,16)17)4-5-12(10)14(6-7-15)21(13,18)19/h4-5,7-8H,6,9H2,1-3H3