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

Systemtic Name: 4-chloranyl-N'-[6-(2-methoxyethylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Openeye Name: 4-chloro-N'-[6-(2-methoxyethylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide CAS Name: 4-chloro-N'-[6-(2-methoxyethylamino)-5-nitro-4-pyrimidinyl]-3-nitrobenzohydrazide IUPAC Name: 4-chloro-N'-[6-(2-methoxyethylamino)-5-nitropyrimidin-4-yl]-3-nitrobenzohydrazide Traditional Name: 4-chloro-N'-[6-(2-methoxyethylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Formula: C14H14ClN7O6 MolecularWeight: 411.75726

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C(=NC=N1)NNC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C(=NC=N1)NNC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H14ClN7O6/c1-28-5-4-16-12-11(22(26)27)13(18-7-17-12)19-20-14(23)8-2-3-9(15)10(6-8)21(24)25/h2-3,6-7H,4-5H2,1H3,(H,20,23)(H2,16,17,18,19)