[1-(phenylmethyl)piperidin-4-yl] 6-azanylpyridine-3-carboxylate hydrochloride

Systemtic Name: [1-(phenylmethyl)piperidin-4-yl] 6-azanylpyridine-3-carboxylate hydrochloride Openeye Name: (1-benzyl-4-piperidyl) 6-aminopyridine-3-carboxylate hydrochloride CAS Name: 6-amino-3-pyridinecarboxylic acid [1-(phenylmethyl)-4-piperidinyl] ester hydrochloride IUPAC Name: (1-benzylpiperidin-4-yl) 6-aminopyridine-3-carboxylate hydrochloride Traditional Name: 6-aminonicotinic acid (1-benzyl-4-piperidyl) ester hydrochloride Formula: C18H22ClN3O2 MolecularWeight: 347.83918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC(=O)C2=CN=C(C=C2)N)CC3=CC=CC=C3.Cl

Isomeric SMILES

C1CN(CCC1OC(=O)C2=CN=C(C=C2)N)CC3=CC=CC=C3.Cl

InChI

InChI=1S/C18H21N3O2.ClH/c19-17-7-6-15(12-20-17)18(22)23-16-8-10-21(11-9-16)13-14-4-2-1-3-5-14;/h1-7,12,16H,8-11,13H2,(H2,19,20);1H