4-nitro-N'-[5-nitro-6-(quinolin-5-ylamino)pyrimidin-4-yl]benzohydrazide

Systemtic Name: 4-nitro-N'-[5-nitro-6-(quinolin-5-ylamino)pyrimidin-4-yl]benzohydrazide Openeye Name: 4-nitro-N'-[5-nitro-6-(5-quinolylamino)pyrimidin-4-yl]benzohydrazide CAS Name: 4-nitro-N'-[5-nitro-6-(5-quinolinylamino)-4-pyrimidinyl]benzohydrazide IUPAC Name: 4-nitro-N'-[5-nitro-6-(quinolin-5-ylamino)pyrimidin-4-yl]benzohydrazide Traditional Name: 4-nitro-N'-[5-nitro-6-(5-quinolylamino)pyrimidin-4-yl]benzohydrazide Formula: C20H14N8O5 MolecularWeight: 446.37576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=N2)C(=C1)NC3=C(C(=NC=N3)NNC(=O)C4=CC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC=N2)C(=C1)NC3=C(C(=NC=N3)NNC(=O)C4=CC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H14N8O5/c29-20(12-6-8-13(9-7-12)27(30)31)26-25-19-17(28(32)33)18(22-11-23-19)24-16-5-1-4-15-14(16)3-2-10-21-15/h1-11H,(H,26,29)(H2,22,23,24,25)