ethanedioic acid; 1-(2-methoxyphenyl)-4-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]piperazine

Systemtic Name: ethanedioic acid; 1-(2-methoxyphenyl)-4-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]piperazine Openeye Name: 1-(2-methoxyphenyl)-4-[1-(1-naphthylmethyl)-4-piperidyl]piperazine; oxalic acid CAS Name: 1-(2-methoxyphenyl)-4-[1-(1-naphthalenylmethyl)-4-piperidinyl]piperazine; oxalic acid IUPAC Name: 1-(2-methoxyphenyl)-4-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]piperazine; oxalic acid Traditional Name: 1-(2-methoxyphenyl)-4-[1-(1-naphthylmethyl)-4-piperidyl]piperazine; oxalic acid Formula: C29H35N3O5 MolecularWeight: 505.6053

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3CCN(CC3)CC4=CC=CC5=CC=CC=C54.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3CCN(CC3)CC4=CC=CC5=CC=CC=C54.C(=O)(C(=O)O)O

InChI

InChI=1S/C27H33N3O.C2H2O4/c1-31-27-12-5-4-11-26(27)30-19-17-29(18-20-30)24-13-15-28(16-14-24)21-23-9-6-8-22-7-2-3-10-25(22)23;3-1(4)2(5)6/h2-12,24H,13-21H2,1H3;(H,3,4)(H,5,6)