[6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]diazane

Systemtic Name: [6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]diazane Openeye Name: [6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]hydrazine CAS Name: [6-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]hydrazine IUPAC Name: [6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]hydrazine Traditional Name: [5-nitro-6-(4-piperonylpiperazino)pyrimidin-4-yl]hydrazine Formula: C16H19N7O4 MolecularWeight: 373.36656

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=C(C(=NC=N4)NN)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=C(C(=NC=N4)NN)[N+](=O)[O-]

InChI

InChI=1S/C16H19N7O4/c17-20-15-14(23(24)25)16(19-9-18-15)22-5-3-21(4-6-22)8-11-1-2-12-13(7-11)27-10-26-12/h1-2,7,9H,3-6,8,10,17H2,(H,18,19,20)