1-[2,3-bis(chloranyl)-4-(4-methylphenyl)sulfonyl-phenoxy]-4,4-dimethyl-pentan-2-ol

Systemtic Name: 1-[2,3-bis(chloranyl)-4-(4-methylphenyl)sulfonyl-phenoxy]-4,4-dimethyl-pentan-2-ol Openeye Name: 1-[2,3-dichloro-4-(p-tolylsulfonyl)phenoxy]-4,4-dimethyl-pentan-2-ol CAS Name: 1-[2,3-dichloro-4-(4-methylphenyl)sulfonylphenoxy]-4,4-dimethyl-2-pentanol IUPAC Name: 1-[2,3-dichloro-4-(4-methylphenyl)sulfonylphenoxy]-4,4-dimethylpentan-2-ol Traditional Name: 1-(2,3-dichloro-4-tosyl-phenoxy)-4,4-dimethyl-pentan-2-ol Formula: C20H24Cl2O4S MolecularWeight: 431.37316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C(=C(C=C2)OCC(CC(C)(C)C)O)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C(=C(C=C2)OCC(CC(C)(C)C)O)Cl)Cl

InChI

InChI=1S/C20H24Cl2O4S/c1-13-5-7-15(8-6-13)27(24,25)17-10-9-16(18(21)19(17)22)26-12-14(23)11-20(2,3)4/h5-10,14,23H,11-12H2,1-4H3