ethanedioic acid; 1-[(2-methoxyphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine

Systemtic Name: ethanedioic acid; 1-[(2-methoxyphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine Openeye Name: 1-[(2-methoxyphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine; oxalic acid CAS Name: 1-[(2-methoxyphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-[(2-methoxyphenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine; oxalic acid Traditional Name: 1-(4-nitrobenzyl)-4-o-anisyl-piperazine; oxalic acid Formula: C21H25N3O7 MolecularWeight: 431.4391

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2CCN(CC2)CC3=CC=C(C=C3)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1CN2CCN(CC2)CC3=CC=C(C=C3)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C19H23N3O3.C2H2O4/c1-25-19-5-3-2-4-17(19)15-21-12-10-20(11-13-21)14-16-6-8-18(9-7-16)22(23)24;3-1(4)2(5)6/h2-9H,10-15H2,1H3;(H,3,4)(H,5,6)