1-(1,3-benzodioxol-5-ylmethyl)-4-(2-methyl-5-nitro-1,2,4-triazol-3-yl)piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(2-methyl-5-nitro-1,2,4-triazol-3-yl)piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(2-methyl-5-nitro-1,2,4-triazol-3-yl)piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(2-methyl-5-nitro-1,2,4-triazol-3-yl)piperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(2-methyl-5-nitro-1,2,4-triazol-3-yl)piperazine Traditional Name: 1-(2-methyl-5-nitro-1,2,4-triazol-3-yl)-4-piperonyl-piperazine Formula: C15H18N6O4 MolecularWeight: 346.34122

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)[N+](=O)[O-])N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C(=NC(=N1)[N+](=O)[O-])N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C15H18N6O4/c1-18-15(16-14(17-18)21(22)23)20-6-4-19(5-7-20)9-11-2-3-12-13(8-11)25-10-24-12/h2-3,8H,4-7,9-10H2,1H3