N'-[6-[(2-methylquinolin-8-yl)amino]-5-nitro-pyrimidin-4-yl]-2-phenoxy-ethanehydrazide

Systemtic Name: N'-[6-[(2-methylquinolin-8-yl)amino]-5-nitro-pyrimidin-4-yl]-2-phenoxy-ethanehydrazide Openeye Name: N'-[6-[(2-methyl-8-quinolyl)amino]-5-nitro-pyrimidin-4-yl]-2-phenoxy-acetohydrazide CAS Name: N'-[6-[(2-methyl-8-quinolinyl)amino]-5-nitro-4-pyrimidinyl]-2-phenoxyacetohydrazide IUPAC Name: N'-[6-[(2-methylquinolin-8-yl)amino]-5-nitropyrimidin-4-yl]-2-phenoxyacetohydrazide Traditional Name: N'-[6-[(2-methyl-8-quinolyl)amino]-5-nitro-pyrimidin-4-yl]-2-phenoxy-acetohydrazide Formula: C22H19N7O4 MolecularWeight: 445.43076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC3=C(C(=NC=N3)NNC(=O)COC4=CC=CC=C4)[N+](=O)[O-])C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC3=C(C(=NC=N3)NNC(=O)COC4=CC=CC=C4)[N+](=O)[O-])C=C1

InChI

InChI=1S/C22H19N7O4/c1-14-10-11-15-6-5-9-17(19(15)25-14)26-21-20(29(31)32)22(24-13-23-21)28-27-18(30)12-33-16-7-3-2-4-8-16/h2-11,13H,12H2,1H3,(H,27,30)(H2,23,24,26,28)