ethyl 1-[3-(2-bromanylphenoxy)-2-oxidanyl-propyl]piperidine-4-carboxylate hydrochloride

Systemtic Name: ethyl 1-[3-(2-bromanylphenoxy)-2-oxidanyl-propyl]piperidine-4-carboxylate hydrochloride Openeye Name: ethyl 1-[3-(2-bromophenoxy)-2-hydroxy-propyl]piperidine-4-carboxylate hydrochloride CAS Name: 1-[3-(2-bromophenoxy)-2-hydroxypropyl]-4-piperidinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 1-[3-(2-bromophenoxy)-2-hydroxypropyl]piperidine-4-carboxylate hydrochloride Traditional Name: 1-[3-(2-bromophenoxy)-2-hydroxy-propyl]isonipecotic acid ethyl ester hydrochloride Formula: C17H25BrClNO4 MolecularWeight: 422.7417

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC(COC2=CC=CC=C2Br)O.Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC(COC2=CC=CC=C2Br)O.Cl

InChI

InChI=1S/C17H24BrNO4.ClH/c1-2-22-17(21)13-7-9-19(10-8-13)11-14(20)12-23-16-6-4-3-5-15(16)18;/h3-6,13-14,20H,2,7-12H2,1H3;1H