1-[4-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-3-(2,6-dimethylphenoxy)propan-2-ol

Systemtic Name: 1-[4-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-3-(2,6-dimethylphenoxy)propan-2-ol Openeye Name: 1-[4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-3-(2,6-dimethylphenoxy)propan-2-ol CAS Name: 1-[4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-3-(2,6-dimethylphenoxy)-2-propanol IUPAC Name: 1-[4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-3-(2,6-dimethylphenoxy)propan-2-ol Traditional Name: 1-[4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonylpiperazino]-3-(2,6-dimethylphenoxy)propan-2-ol Formula: C22H26ClF3N2O4S MolecularWeight: 506.96605

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(CN2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(CN2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)O

InChI

InChI=1S/C22H26ClF3N2O4S/c1-15-4-3-5-16(2)21(15)32-14-18(29)13-27-8-10-28(11-9-27)33(30,31)20-12-17(22(24,25)26)6-7-19(20)23/h3-7,12,18,29H,8-11,13-14H2,1-2H3