(3-ethoxy-4-methoxy-phenyl)-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-ethoxy-4-methoxy-phenyl)-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: (3-ethoxy-4-methoxy-phenyl)-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone CAS Name: (3-ethoxy-4-methoxyphenyl)-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: (3-ethoxy-4-methoxyphenyl)-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: (3-ethoxy-4-methoxy-phenyl)-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]methanone Formula: C21H23F3N2O5S MolecularWeight: 472.47793

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)OC

InChI

InChI=1S/C21H23F3N2O5S/c1-3-31-19-13-15(7-8-18(19)30-2)20(27)25-9-11-26(12-10-25)32(28,29)17-6-4-5-16(14-17)21(22,23)24/h4-8,13-14H,3,9-12H2,1-2H3