[1-(methylamino)-1-oxidanylidene-propan-2-yl] 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate

Systemtic Name: [1-(methylamino)-1-oxidanylidene-propan-2-yl] 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate Openeye Name: [1-methyl-2-(methylamino)-2-oxo-ethyl] 1-(4-fluorobenzoyl)piperidine-3-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-3-piperidinecarboxylic acid [1-(methylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(methylamino)-1-oxopropan-2-yl] 1-(4-fluorobenzoyl)piperidine-3-carboxylate Traditional Name: 1-(4-fluorobenzoyl)nipecotic acid [2-keto-1-methyl-2-(methylamino)ethyl] ester Formula: C17H21FN2O4 MolecularWeight: 336.358043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC)OC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C(=O)NC)OC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H21FN2O4/c1-11(15(21)19-2)24-17(23)13-4-3-9-20(10-13)16(22)12-5-7-14(18)8-6-12/h5-8,11,13H,3-4,9-10H2,1-2H3,(H,19,21)