[2-(methylamino)-2-oxidanylidene-ethyl] 4-[2-(4-bromanylphenoxy)ethyl]piperidine-1-carboxylate

Systemtic Name: [2-(methylamino)-2-oxidanylidene-ethyl] 4-[2-(4-bromanylphenoxy)ethyl]piperidine-1-carboxylate Openeye Name: [2-(methylamino)-2-oxo-ethyl] 4-[2-(4-bromophenoxy)ethyl]piperidine-1-carboxylate CAS Name: 4-[2-(4-bromophenoxy)ethyl]-1-piperidinecarboxylic acid [2-(methylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylamino)-2-oxoethyl] 4-[2-(4-bromophenoxy)ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-(4-bromophenoxy)ethyl]piperidine-1-carboxylic acid [2-keto-2-(methylamino)ethyl] ester Formula: C17H23BrN2O4 MolecularWeight: 399.27952

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)COC(=O)N1CCC(CC1)CCOC2=CC=C(C=C2)Br

Isomeric SMILES

CNC(=O)COC(=O)N1CCC(CC1)CCOC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H23BrN2O4/c1-19-16(21)12-24-17(22)20-9-6-13(7-10-20)8-11-23-15-4-2-14(18)3-5-15/h2-5,13H,6-12H2,1H3,(H,19,21)