methyl 2-[ethyl-[1-(phenylmethyl)piperidin-4-yl]amino]pyridine-3-carboxylate

Systemtic Name: methyl 2-[ethyl-[1-(phenylmethyl)piperidin-4-yl]amino]pyridine-3-carboxylate Openeye Name: methyl 2-[(1-benzyl-4-piperidyl)-ethyl-amino]pyridine-3-carboxylate CAS Name: 2-[ethyl-[1-(phenylmethyl)-4-piperidinyl]amino]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(1-benzylpiperidin-4-yl)-ethylamino]pyridine-3-carboxylate Traditional Name: 2-[(1-benzyl-4-piperidyl)-ethyl-amino]nicotinic acid methyl ester Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(CC1)CC2=CC=CC=C2)C3=C(C=CC=N3)C(=O)OC

Isomeric SMILES

CCN(C1CCN(CC1)CC2=CC=CC=C2)C3=C(C=CC=N3)C(=O)OC

InChI

InChI=1S/C21H27N3O2/c1-3-24(20-19(21(25)26-2)10-7-13-22-20)18-11-14-23(15-12-18)16-17-8-5-4-6-9-17/h4-10,13,18H,3,11-12,14-16H2,1-2H3