1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-nitropyrazol-1-yl)methyl]piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-nitropyrazol-1-yl)methyl]piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-nitropyrazol-1-yl)methyl]piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-nitro-1-pyrazolyl)methyl]piperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-nitropyrazol-1-yl)methyl]piperazine Traditional Name: 1-[(4-nitropyrazol-1-yl)methyl]-4-piperonyl-piperazine Formula: C16H19N5O4 MolecularWeight: 345.35316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CN4C=C(C=N4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CN4C=C(C=N4)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O4/c22-21(23)14-8-17-20(10-14)11-19-5-3-18(4-6-19)9-13-1-2-15-16(7-13)25-12-24-15/h1-2,7-8,10H,3-6,9,11-12H2