N'-[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-4-fluoranyl-benzohydrazide

Systemtic Name: N'-[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-4-fluoranyl-benzohydrazide Openeye Name: N'-[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-4-fluoro-benzohydrazide CAS Name: N'-[6-(1-benzotriazolyl)-5-nitro-4-pyrimidinyl]-4-fluorobenzohydrazide IUPAC Name: N'-[6-(benzotriazol-1-yl)-5-nitropyrimidin-4-yl]-4-fluorobenzohydrazide Traditional Name: N'-[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]-4-fluoro-benzohydrazide Formula: C17H11FN8O3 MolecularWeight: 394.319443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C3=C(C(=NC=N3)NNC(=O)C4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C3=C(C(=NC=N3)NNC(=O)C4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C17H11FN8O3/c18-11-7-5-10(6-8-11)17(27)23-22-15-14(26(28)29)16(20-9-19-15)25-13-4-2-1-3-12(13)21-24-25/h1-9H,(H,23,27)(H,19,20,22)