ethanedioic acid; 2-(1-phenylethylamino)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone

Systemtic Name: ethanedioic acid; 2-(1-phenylethylamino)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-(1-phenylethylamino)ethanone; oxalic acid CAS Name: oxalic acid; 2-(1-phenylethylamino)-1-[4-(phenylmethyl)-1-piperidinyl]ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-(1-phenylethylamino)ethanone; oxalic acid Traditional Name: 1-(4-benzylpiperidino)-2-(1-phenylethylamino)ethanone; oxalic acid Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NCC(=O)N2CCC(CC2)CC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C1=CC=CC=C1)NCC(=O)N2CCC(CC2)CC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H28N2O.C2H2O4/c1-18(21-10-6-3-7-11-21)23-17-22(25)24-14-12-20(13-15-24)16-19-8-4-2-5-9-19;3-1(4)2(5)6/h2-11,18,20,23H,12-17H2,1H3;(H,3,4)(H,5,6)