N'-[6-[(2-methylquinolin-5-yl)amino]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide

Systemtic Name: N'-[6-[(2-methylquinolin-5-yl)amino]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Openeye Name: N'-[6-[(2-methyl-5-quinolyl)amino]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide CAS Name: N'-[6-[(2-methyl-5-quinolinyl)amino]-5-nitro-4-pyrimidinyl]-3-nitrobenzohydrazide IUPAC Name: N'-[6-[(2-methylquinolin-5-yl)amino]-5-nitropyrimidin-4-yl]-3-nitrobenzohydrazide Traditional Name: N'-[6-[(2-methyl-5-quinolyl)amino]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Formula: C21H16N8O5 MolecularWeight: 460.40234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)NC3=C(C(=NC=N3)NNC(=O)C4=CC(=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)NC3=C(C(=NC=N3)NNC(=O)C4=CC(=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H16N8O5/c1-12-8-9-15-16(24-12)6-3-7-17(15)25-19-18(29(33)34)20(23-11-22-19)26-27-21(30)13-4-2-5-14(10-13)28(31)32/h2-11H,1H3,(H,27,30)(H2,22,23,25,26)