ethyl 2-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate

Systemtic Name: ethyl 2-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate Openeye Name: ethyl 2-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate CAS Name: 2-[[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methyl]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate Traditional Name: 2-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]methyl]furan-3-carboxylic acid ethyl ester Formula: C19H21F3N2O5S MolecularWeight: 446.44065

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(OC=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H21F3N2O5S/c1-2-28-18(25)16-6-11-29-17(16)13-23-7-9-24(10-8-23)30(26,27)15-5-3-4-14(12-15)19(20,21)22/h3-6,11-12H,2,7-10,13H2,1H3