6-bromanyl-3-methyl-2,2-bis(oxidanylidene)-8-sulfochloranuidyl-3,4-dihydro-1,2$l^{6}-benzoxathiine

Systemtic Name: 6-bromanyl-3-methyl-2,2-bis(oxidanylidene)-8-sulfochloranuidyl-3,4-dihydro-1,2$l^{6}-benzoxathiine Openeye Name: 6-bromo-3-methyl-2,2-dioxo-8-sulfochloranuidyl-3,4-dihydro-1,2$l^{6}-benzoxathiine CAS Name: 6-bromo-3-methyl-2,2-dioxo-8-sulfochloranuidyl-3,4-dihydro-1,2$l^{6}-benzoxathiin IUPAC Name: 6-bromo-3-methyl-2,2-dioxo-8-sulfochloranuidyl-3,4-dihydro-1,2$l^{6}-benzoxathiine Traditional Name: 6-bromo-2,2-diketo-3-methyl-8-sulfochloranuidyl-3,4-dihydro-1,2$l^{6}-benzoxathiin Formula: C9H9BrClO6S2- MolecularWeight: 392.65116

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC(=CC(=C2OS1(=O)=O)[Cl-]S(=O)(=O)O)Br

Isomeric SMILES

CC1CC2=CC(=CC(=C2OS1(=O)=O)[Cl-]S(=O)(=O)O)Br

InChI

InChI=1S/C9H9BrClO6S2/c1-5-2-6-3-7(10)4-8(11-19(14,15)16)9(6)17-18(5,12)13/h3-5H,2H2,1H3,(H,14,15,16)/q-1