4-[[6-methyl-3-(trifluoromethylsulfonyloxy)pyridin-2-yl]carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid

Systemtic Name: 4-[[6-methyl-3-(trifluoromethylsulfonyloxy)pyridin-2-yl]carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid Openeye Name: 4-[[6-methyl-3-(trifluoromethylsulfonyloxy)-2-pyridyl]carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid CAS Name: 4-[[[6-methyl-3-(trifluoromethylsulfonyloxy)-2-pyridinyl]amino]-oxomethyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid IUPAC Name: 4-[[6-methyl-3-(trifluoromethylsulfonyloxy)pyridin-2-yl]carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid Traditional Name: 4-[(6-methyl-3-triflyloxy-2-pyridyl)carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid Formula: C14H14F3N3O6S MolecularWeight: 409.33767

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)OS(=O)(=O)C(F)(F)F)NC(=O)C2=CCN(CC2)C(=O)O

Isomeric SMILES

CC1=NC(=C(C=C1)OS(=O)(=O)C(F)(F)F)NC(=O)C2=CCN(CC2)C(=O)O

InChI

InChI=1S/C14H14F3N3O6S/c1-8-2-3-10(26-27(24,25)14(15,16)17)11(18-8)19-12(21)9-4-6-20(7-5-9)13(22)23/h2-4H,5-7H2,1H3,(H,22,23)(H,18,19,21)