1-(2,5-dinitrophenyl)-4-(phenylmethyl)piperazine

Systemtic Name: 1-(2,5-dinitrophenyl)-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-(2,5-dinitrophenyl)piperazine CAS Name: 1-(2,5-dinitrophenyl)-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-(2,5-dinitrophenyl)piperazine Traditional Name: 1-benzyl-4-(2,5-dinitrophenyl)piperazine Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O4/c22-20(23)15-6-7-16(21(24)25)17(12-15)19-10-8-18(9-11-19)13-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2