ethanedioic acid; 2-naphthalen-2-yloxy-1-[4-[1-(phenylmethyl)piperidin-4-yl]piperazin-1-yl]ethanone

Systemtic Name: ethanedioic acid; 2-naphthalen-2-yloxy-1-[4-[1-(phenylmethyl)piperidin-4-yl]piperazin-1-yl]ethanone Openeye Name: 1-[4-(1-benzyl-4-piperidyl)piperazin-1-yl]-2-(2-naphthyloxy)ethanone; oxalic acid CAS Name: 2-(2-naphthalenyloxy)-1-[4-[1-(phenylmethyl)-4-piperidinyl]-1-piperazinyl]ethanone; oxalic acid IUPAC Name: 1-[4-(1-benzylpiperidin-4-yl)piperazin-1-yl]-2-naphthalen-2-yloxyethanone; oxalic acid Traditional Name: 1-[4-(1-benzyl-4-piperidyl)piperazino]-2-(2-naphthoxy)ethanone; oxalic acid Formula: C30H35N3O6 MolecularWeight: 533.6154

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCN(CC2)C(=O)COC3=CC4=CC=CC=C4C=C3)CC5=CC=CC=C5.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCC1N2CCN(CC2)C(=O)COC3=CC4=CC=CC=C4C=C3)CC5=CC=CC=C5.C(=O)(C(=O)O)O

InChI

InChI=1S/C28H33N3O2.C2H2O4/c32-28(22-33-27-11-10-24-8-4-5-9-25(24)20-27)31-18-16-30(17-19-31)26-12-14-29(15-13-26)21-23-6-2-1-3-7-23;3-1(4)2(5)6/h1-11,20,26H,12-19,21-22H2;(H,3,4)(H,5,6)