1-[[1-[3-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]methyl]azepane

Systemtic Name: 1-[[1-[3-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]methyl]azepane Openeye Name: 1-[[1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidyl]methyl]azepane CAS Name: 1-[[1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinyl]methyl]azepane IUPAC Name: 1-[[1-[3-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]methyl]azepane Traditional Name: 1-[[1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidyl]methyl]azepane Formula: C19H27F3N2O2S MolecularWeight: 404.49009

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)CC2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H27F3N2O2S/c20-19(21,22)17-6-5-7-18(14-17)27(25,26)24-12-8-16(9-13-24)15-23-10-3-1-2-4-11-23/h5-7,14,16H,1-4,8-13,15H2