2-nitro-N'-[5-nitro-6-(quinolin-8-ylamino)pyrimidin-4-yl]benzohydrazide

Systemtic Name: 2-nitro-N'-[5-nitro-6-(quinolin-8-ylamino)pyrimidin-4-yl]benzohydrazide Openeye Name: 2-nitro-N'-[5-nitro-6-(8-quinolylamino)pyrimidin-4-yl]benzohydrazide CAS Name: 2-nitro-N'-[5-nitro-6-(8-quinolinylamino)-4-pyrimidinyl]benzohydrazide IUPAC Name: 2-nitro-N'-[5-nitro-6-(quinolin-8-ylamino)pyrimidin-4-yl]benzohydrazide Traditional Name: 2-nitro-N'-[5-nitro-6-(8-quinolylamino)pyrimidin-4-yl]benzohydrazide Formula: C20H14N8O5 MolecularWeight: 446.37576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

InChI

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