[2-(tert-butylamino)-2-oxidanylidene-ethyl] 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 1-(4-fluorobenzoyl)piperidine-3-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-3-piperidinecarboxylic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 1-(4-fluorobenzoyl)piperidine-3-carboxylate Traditional Name: 1-(4-fluorobenzoyl)nipecotic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C19H25FN2O4 MolecularWeight: 364.411203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25FN2O4/c1-19(2,3)21-16(23)12-26-18(25)14-5-4-10-22(11-14)17(24)13-6-8-15(20)9-7-13/h6-9,14H,4-5,10-12H2,1-3H3,(H,21,23)