ethyl 1-[3-(6-bromanylnaphthalen-2-yl)oxy-2-oxidanyl-propyl]piperidine-4-carboxylate hydrochloride

Systemtic Name: ethyl 1-[3-(6-bromanylnaphthalen-2-yl)oxy-2-oxidanyl-propyl]piperidine-4-carboxylate hydrochloride Openeye Name: ethyl 1-[3-[(6-bromo-2-naphthyl)oxy]-2-hydroxy-propyl]piperidine-4-carboxylate hydrochloride CAS Name: 1-[3-[(6-bromo-2-naphthalenyl)oxy]-2-hydroxypropyl]-4-piperidinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 1-[3-(6-bromonaphthalen-2-yl)oxy-2-hydroxypropyl]piperidine-4-carboxylate hydrochloride Traditional Name: 1-[3-(6-bromo-2-naphthoxy)-2-hydroxy-propyl]isonipecotic acid ethyl ester hydrochloride Formula: C21H27BrClNO4 MolecularWeight: 472.80038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC(COC2=CC3=C(C=C2)C=C(C=C3)Br)O.Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC(COC2=CC3=C(C=C2)C=C(C=C3)Br)O.Cl

InChI

InChI=1S/C21H26BrNO4.ClH/c1-2-26-21(25)15-7-9-23(10-8-15)13-19(24)14-27-20-6-4-16-11-18(22)5-3-17(16)12-20;/h3-6,11-12,15,19,24H,2,7-10,13-14H2,1H3;1H