ethanedioic acid; 1-(naphthalen-1-ylmethyl)-4-[(4-nitrophenyl)methyl]piperazine

Systemtic Name: ethanedioic acid; 1-(naphthalen-1-ylmethyl)-4-[(4-nitrophenyl)methyl]piperazine Openeye Name: 1-(1-naphthylmethyl)-4-[(4-nitrophenyl)methyl]piperazine; oxalic acid CAS Name: 1-(1-naphthalenylmethyl)-4-[(4-nitrophenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-(naphthalen-1-ylmethyl)-4-[(4-nitrophenyl)methyl]piperazine; oxalic acid Traditional Name: 1-(1-naphthylmethyl)-4-(4-nitrobenzyl)piperazine; oxalic acid Formula: C24H25N3O6 MolecularWeight: 451.4718

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H23N3O2.C2H2O4/c26-25(27)21-10-8-18(9-11-21)16-23-12-14-24(15-13-23)17-20-6-3-5-19-4-1-2-7-22(19)20;3-1(4)2(5)6/h1-11H,12-17H2;(H,3,4)(H,5,6)