ethyl 1-[3-[2,4-bis(bromanyl)phenoxy]-2-oxidanyl-propyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[2,4-bis(bromanyl)phenoxy]-2-oxidanyl-propyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(2,4-dibromophenoxy)-2-hydroxy-propyl]piperidine-4-carboxylate CAS Name: 1-[3-(2,4-dibromophenoxy)-2-hydroxypropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2,4-dibromophenoxy)-2-hydroxypropyl]piperidine-4-carboxylate Traditional Name: 1-[3-(2,4-dibromophenoxy)-2-hydroxy-propyl]isonipecotic acid ethyl ester Formula: C17H23Br2NO4 MolecularWeight: 465.17682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC(COC2=C(C=C(C=C2)Br)Br)O

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC(COC2=C(C=C(C=C2)Br)Br)O

InChI

InChI=1S/C17H23Br2NO4/c1-2-23-17(22)12-5-7-20(8-6-12)10-14(21)11-24-16-4-3-13(18)9-15(16)19/h3-4,9,12,14,21H,2,5-8,10-11H2,1H3