2-[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenoxy]ethyl pyridine-3-carboxylate hydrochloride

Systemtic Name: 2-[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenoxy]ethyl pyridine-3-carboxylate hydrochloride Openeye Name: 2-[4-[3-(2-naphthylmethoxy)-4-piperidyl]phenoxy]ethyl pyridine-3-carboxylate hydrochloride CAS Name: 3-pyridinecarboxylic acid 2-[4-[3-(2-naphthalenylmethoxy)-4-piperidinyl]phenoxy]ethyl ester hydrochloride IUPAC Name: 2-[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenoxy]ethyl pyridine-3-carboxylate hydrochloride Traditional Name: nicotinic acid 2-[4-[3-(2-naphthylmethoxy)-4-piperidyl]phenoxy]ethyl ester hydrochloride Formula: C30H31ClN2O4 MolecularWeight: 519.03114

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C1C2=CC=C(C=C2)OCCOC(=O)C3=CN=CC=C3)OCC4=CC5=CC=CC=C5C=C4.Cl

Isomeric SMILES

C1CNCC(C1C2=CC=C(C=C2)OCCOC(=O)C3=CN=CC=C3)OCC4=CC5=CC=CC=C5C=C4.Cl

InChI

InChI=1S/C30H30N2O4.ClH/c33-30(26-6-3-14-31-19-26)35-17-16-34-27-11-9-24(10-12-27)28-13-15-32-20-29(28)36-21-22-7-8-23-4-1-2-5-25(23)18-22;/h1-12,14,18-19,28-29,32H,13,15-17,20-21H2;1H