ethanedioic acid; N-phenyl-N-[1-(phenylmethyl)-4-pyridin-2-yl-piperidin-4-yl]propanamide

Systemtic Name: ethanedioic acid; N-phenyl-N-[1-(phenylmethyl)-4-pyridin-2-yl-piperidin-4-yl]propanamide Openeye Name: N-[1-benzyl-4-(2-pyridyl)-4-piperidyl]-N-phenyl-propanamide; oxalic acid CAS Name: oxalic acid; N-phenyl-N-[1-(phenylmethyl)-4-(2-pyridinyl)-4-piperidinyl]propanamide IUPAC Name: N-(1-benzyl-4-pyridin-2-ylpiperidin-4-yl)-N-phenylpropanamide; oxalic acid Traditional Name: N-[1-benzyl-4-(2-pyridyl)-4-piperidyl]-N-phenyl-propionamide; oxalic acid Formula: C28H31N3O5 MolecularWeight: 489.56284

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=N4.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=N4.C(=O)(C(=O)O)O

InChI

InChI=1S/C26H29N3O.C2H2O4/c1-2-25(30)29(23-13-7-4-8-14-23)26(24-15-9-10-18-27-24)16-19-28(20-17-26)21-22-11-5-3-6-12-22;3-1(4)2(5)6/h3-15,18H,2,16-17,19-21H2,1H3;(H,3,4)(H,5,6)