1-(2,6-dinitrophenyl)-4-(phenylmethyl)piperazine

Systemtic Name: 1-(2,6-dinitrophenyl)-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-(2,6-dinitrophenyl)piperazine CAS Name: 1-(2,6-dinitrophenyl)-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-(2,6-dinitrophenyl)piperazine Traditional Name: 1-benzyl-4-(2,6-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)15-7-4-8-16(21(24)25)17(15)19-11-9-18(10-12-19)13-14-5-2-1-3-6-14/h1-8H,9-13H2