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

Systemtic Name: 4-chloranyl-N'-[6-[(2-fluorophenyl)amino]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Openeye Name: 4-chloro-N'-[6-(2-fluoroanilino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide CAS Name: 4-chloro-N'-[6-(2-fluoroanilino)-5-nitro-4-pyrimidinyl]-3-nitrobenzohydrazide IUPAC Name: 4-chloro-N'-[6-(2-fluoroanilino)-5-nitropyrimidin-4-yl]-3-nitrobenzohydrazide Traditional Name: 4-chloro-N'-[6-(2-fluoroanilino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Formula: C17H11ClFN7O5 MolecularWeight: 447.764543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-])F

InChI

InChI=1S/C17H11ClFN7O5/c18-10-6-5-9(7-13(10)25(28)29)17(27)24-23-16-14(26(30)31)15(20-8-21-16)22-12-4-2-1-3-11(12)19/h1-8H,(H,24,27)(H2,20,21,22,23)