ethanedioic acid; 2-naphthalen-2-yloxy-1-[4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]ethanone

Systemtic Name: ethanedioic acid; 2-naphthalen-2-yloxy-1-[4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-(2-naphthyloxy)-1-[4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]ethanone; oxalic acid CAS Name: 2-(2-naphthalenyloxy)-1-[4-[(2,4,5-trimethoxyphenyl)methyl]-1-piperazinyl]ethanone; oxalic acid IUPAC Name: 2-naphthalen-2-yloxy-1-[4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]ethanone; oxalic acid Traditional Name: 2-(2-naphthoxy)-1-[4-(2,4,5-trimethoxybenzyl)piperazino]ethanone; oxalic acid Formula: C28H32N2O9 MolecularWeight: 540.56168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CN2CCN(CC2)C(=O)COC3=CC4=CC=CC=C4C=C3)OC)OC.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC(=C(C=C1CN2CCN(CC2)C(=O)COC3=CC4=CC=CC=C4C=C3)OC)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C26H30N2O5.C2H2O4/c1-30-23-16-25(32-3)24(31-2)15-21(23)17-27-10-12-28(13-11-27)26(29)18-33-22-9-8-19-6-4-5-7-20(19)14-22;3-1(4)2(5)6/h4-9,14-16H,10-13,17-18H2,1-3H3;(H,3,4)(H,5,6)