[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl pyrazine-2-carboxylate hydrochloride

Systemtic Name: [4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl pyrazine-2-carboxylate hydrochloride Openeye Name: [4-[3-(2-naphthylmethoxy)-4-piperidyl]phenyl]methyl pyrazine-2-carboxylate hydrochloride CAS Name: 2-pyrazinecarboxylic acid [4-[3-(2-naphthalenylmethoxy)-4-piperidinyl]phenyl]methyl ester hydrochloride IUPAC Name: [4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methyl pyrazine-2-carboxylate hydrochloride Traditional Name: pyrazinic acid [4-[3-(2-naphthylmethoxy)-4-piperidyl]benzyl] ester hydrochloride Formula: C28H28ClN3O3 MolecularWeight: 489.99322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H27N3O3.ClH/c32-28(26-16-30-13-14-31-26)34-18-20-5-9-23(10-6-20)25-11-12-29-17-27(25)33-19-21-7-8-22-3-1-2-4-24(22)15-21;/h1-10,13-16,25,27,29H,11-12,17-19H2;1H