ethanedioic acid; [1-[(4-phenylmethoxyphenyl)methyl]piperidin-4-yl]-piperidin-1-yl-methanone

Systemtic Name: ethanedioic acid; [1-[(4-phenylmethoxyphenyl)methyl]piperidin-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-[(4-benzyloxyphenyl)methyl]-4-piperidyl]-(1-piperidyl)methanone; oxalic acid CAS Name: oxalic acid; [1-[(4-phenylmethoxyphenyl)methyl]-4-piperidinyl]-(1-piperidinyl)methanone IUPAC Name: oxalic acid; [1-[(4-phenylmethoxyphenyl)methyl]piperidin-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-(4-benzoxybenzyl)-4-piperidyl]-piperidino-methanone; oxalic acid Formula: C27H34N2O6 MolecularWeight: 482.56866

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CCN(CC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)C(=O)C2CCN(CC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H32N2O2.C2H2O4/c28-25(27-15-5-2-6-16-27)23-13-17-26(18-14-23)19-21-9-11-24(12-10-21)29-20-22-7-3-1-4-8-22;3-1(4)2(5)6/h1,3-4,7-12,23H,2,5-6,13-20H2;(H,3,4)(H,5,6)