N'-[6-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide

Systemtic Name: N'-[6-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Openeye Name: N'-[6-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide CAS Name: N'-[6-(3-methoxypropylamino)-5-nitro-4-pyrimidinyl]-3-nitrobenzohydrazide IUPAC Name: N'-[6-(3-methoxypropylamino)-5-nitropyrimidin-4-yl]-3-nitrobenzohydrazide Traditional Name: N'-[6-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Formula: C15H17N7O6 MolecularWeight: 391.33878

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=C(C(=NC=N1)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COCCCNC1=C(C(=NC=N1)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H17N7O6/c1-28-7-3-6-16-13-12(22(26)27)14(18-9-17-13)19-20-15(23)10-4-2-5-11(8-10)21(24)25/h2,4-5,8-9H,3,6-7H2,1H3,(H,20,23)(H2,16,17,18,19)