2-chloranyl-1-[3-methoxy-4-(4-methylphenyl)sulfonyl-phenoxy]-4-(trifluoromethyl)benzene

Systemtic Name: 2-chloranyl-1-[3-methoxy-4-(4-methylphenyl)sulfonyl-phenoxy]-4-(trifluoromethyl)benzene Openeye Name: 2-chloro-1-[3-methoxy-4-(p-tolylsulfonyl)phenoxy]-4-(trifluoromethyl)benzene CAS Name: 2-chloro-1-[3-methoxy-4-(4-methylphenyl)sulfonylphenoxy]-4-(trifluoromethyl)benzene IUPAC Name: 2-chloro-1-[3-methoxy-4-(4-methylphenyl)sulfonylphenoxy]-4-(trifluoromethyl)benzene Traditional Name: 2-chloro-1-(3-methoxy-4-tosyl-phenoxy)-4-(trifluoromethyl)benzene Formula: C21H16ClF3O4S MolecularWeight: 456.86255

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)OC

InChI

InChI=1S/C21H16ClF3O4S/c1-13-3-7-16(8-4-13)30(26,27)20-10-6-15(12-19(20)28-2)29-18-9-5-14(11-17(18)22)21(23,24)25/h3-12H,1-2H3