ethyl 4-[4-[[2-oxidanylidene-4-(trifluoromethyl)chromen-6-yl]methyl]phenyl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-[[2-oxidanylidene-4-(trifluoromethyl)chromen-6-yl]methyl]phenyl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[[2-oxo-4-(trifluoromethyl)chromen-6-yl]methyl]phenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[4-[[2-oxo-4-(trifluoromethyl)-1-benzopyran-6-yl]methyl]phenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[[2-oxo-4-(trifluoromethyl)chromen-6-yl]methyl]phenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[4-[[2-keto-4-(trifluoromethyl)chromen-6-yl]methyl]phenyl]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C24H23F3N2O6S MolecularWeight: 524.50943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC3=CC4=C(C=C3)OC(=O)C=C4C(F)(F)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC3=CC4=C(C=C3)OC(=O)C=C4C(F)(F)F

InChI

InChI=1S/C24H23F3N2O6S/c1-2-34-23(31)28-9-11-29(12-10-28)36(32,33)18-6-3-16(4-7-18)13-17-5-8-21-19(14-17)20(24(25,26)27)15-22(30)35-21/h3-8,14-15H,2,9-13H2,1H3