ethyl 4-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonylpiperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonylpiperidine-1-carboxylate Openeye Name: ethyl 4-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylate CAS Name: 4-[oxo-[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylate Traditional Name: 4-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylic acid ethyl ester Formula: C20H26F3N3O5S MolecularWeight: 477.49775

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)N1CCC(CC1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H26F3N3O5S/c1-2-31-19(28)25-9-7-15(8-10-25)18(27)24-11-13-26(14-12-24)32(29,30)17-5-3-16(4-6-17)20(21,22)23/h3-6,15H,2,7-14H2,1H3