methyl 4-methyl-3-[3-(trifluoromethyl)piperidin-1-yl]sulfonyl-benzoate

Systemtic Name: methyl 4-methyl-3-[3-(trifluoromethyl)piperidin-1-yl]sulfonyl-benzoate Openeye Name: methyl 4-methyl-3-[[3-(trifluoromethyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 4-methyl-3-[[3-(trifluoromethyl)-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[3-(trifluoromethyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-methyl-3-[3-(trifluoromethyl)piperidino]sulfonyl-benzoic acid methyl ester Formula: C15H18F3NO4S MolecularWeight: 365.36793

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)N2CCCC(C2)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)N2CCCC(C2)C(F)(F)F

InChI

InChI=1S/C15H18F3NO4S/c1-10-5-6-11(14(20)23-2)8-13(10)24(21,22)19-7-3-4-12(9-19)15(16,17)18/h5-6,8,12H,3-4,7,9H2,1-2H3