ethanedioic acid; 1-[phenyl-(3,4,5-trimethoxyphenyl)methyl]piperazine

Systemtic Name: ethanedioic acid; 1-[phenyl-(3,4,5-trimethoxyphenyl)methyl]piperazine Openeye Name: oxalic acid; 1-[phenyl-(3,4,5-trimethoxyphenyl)methyl]piperazine CAS Name: oxalic acid; 1-[phenyl-(3,4,5-trimethoxyphenyl)methyl]piperazine IUPAC Name: oxalic acid; 1-[phenyl-(3,4,5-trimethoxyphenyl)methyl]piperazine Traditional Name: oxalic acid; 1-[phenyl-(3,4,5-trimethoxyphenyl)methyl]piperazine Formula: C22H28N2O7 MolecularWeight: 432.46692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(C2=CC=CC=C2)N3CCNCC3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(C2=CC=CC=C2)N3CCNCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H26N2O3.C2H2O4/c1-23-17-13-16(14-18(24-2)20(17)25-3)19(15-7-5-4-6-8-15)22-11-9-21-10-12-22;3-1(4)2(5)6/h4-8,13-14,19,21H,9-12H2,1-3H3;(H,3,4)(H,5,6)