(4-methylphenyl) [1,1,1-tris(chloranyl)-3-methyl-4-naphthalen-2-yl-4-oxidanylidene-butan-2-yl] sulfite

Systemtic Name: (4-methylphenyl) [1,1,1-tris(chloranyl)-3-methyl-4-naphthalen-2-yl-4-oxidanylidene-butan-2-yl] sulfite Openeye Name: [2-methyl-3-(2-naphthyl)-3-oxo-1-(trichloromethyl)propyl] p-tolyl sulfite CAS Name: sulfurous acid (4-methylphenyl) [1,1,1-trichloro-3-methyl-4-(2-naphthalenyl)-4-oxobutan-2-yl] ester IUPAC Name: (4-methylphenyl) (1,1,1-trichloro-3-methyl-4-naphthalen-2-yl-4-oxobutan-2-yl) sulfite Traditional Name: sulfurous acid [3-keto-2-methyl-3-(2-naphthyl)-1-(trichloromethyl)propyl] p-tolyl ester Formula: C22H19Cl3O4S MolecularWeight: 485.80786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)OC(C(C)C(=O)C2=CC3=CC=CC=C3C=C2)C(Cl)(Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)OC(C(C)C(=O)C2=CC3=CC=CC=C3C=C2)C(Cl)(Cl)Cl

InChI

InChI=1S/C22H19Cl3O4S/c1-14-7-11-19(12-8-14)28-30(27)29-21(22(23,24)25)15(2)20(26)18-10-9-16-5-3-4-6-17(16)13-18/h3-13,15,21H,1-2H3