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

Systemtic Name: ethanedioic acid; N-phenyl-N-[1-(phenylmethyl)-4-pyrrolidin-1-ylcarbonyl-piperidin-4-yl]propanamide Openeye Name: N-[1-benzyl-4-(pyrrolidine-1-carbonyl)-4-piperidyl]-N-phenyl-propanamide; oxalic acid CAS Name: oxalic acid; N-[4-[oxo(1-pyrrolidinyl)methyl]-1-(phenylmethyl)-4-piperidinyl]-N-phenylpropanamide IUPAC Name: N-[1-benzyl-4-(pyrrolidine-1-carbonyl)piperidin-4-yl]-N-phenylpropanamide; oxalic acid Traditional Name: N-[1-benzyl-4-(pyrrolidine-1-carbonyl)-4-piperidyl]-N-phenyl-propionamide; oxalic acid Formula: C28H35N3O6 MolecularWeight: 509.594

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CC3=CC=CC=C3)C(=O)N4CCCC4.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CC3=CC=CC=C3)C(=O)N4CCCC4.C(=O)(C(=O)O)O

InChI

InChI=1S/C26H33N3O2.C2H2O4/c1-2-24(30)29(23-13-7-4-8-14-23)26(25(31)28-17-9-10-18-28)15-19-27(20-16-26)21-22-11-5-3-6-12-22;3-1(4)2(5)6/h3-8,11-14H,2,9-10,15-21H2,1H3;(H,3,4)(H,5,6)