N'-[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-2-phenoxy-ethanehydrazide

Systemtic Name: N'-[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-2-phenoxy-ethanehydrazide Openeye Name: N'-[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-2-phenoxy-acetohydrazide CAS Name: N'-[6-(1-benzotriazolyl)-5-nitro-4-pyrimidinyl]-2-phenoxyacetohydrazide IUPAC Name: N'-[6-(benzotriazol-1-yl)-5-nitropyrimidin-4-yl]-2-phenoxyacetohydrazide Traditional Name: N'-[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-2-phenoxy-acetohydrazide Formula: C18H14N8O4 MolecularWeight: 406.35496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(=O)NNC2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C(C=C1)OCC(=O)NNC2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H14N8O4/c27-15(10-30-12-6-2-1-3-7-12)22-23-17-16(26(28)29)18(20-11-19-17)25-14-9-5-4-8-13(14)21-24-25/h1-9,11H,10H2,(H,22,27)(H,19,20,23)