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

Systemtic Name: N'-[6-(cyclopentylamino)-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide Openeye Name: N'-[6-(cyclopentylamino)-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide CAS Name: N'-[6-(cyclopentylamino)-5-nitro-4-pyrimidinyl]-4-nitrobenzohydrazide IUPAC Name: N'-[6-(cyclopentylamino)-5-nitropyrimidin-4-yl]-4-nitrobenzohydrazide Traditional Name: N'-[6-(cyclopentylamino)-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide Formula: C16H17N7O5 MolecularWeight: 387.35008

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H17N7O5/c24-16(10-5-7-12(8-6-10)22(25)26)21-20-15-13(23(27)28)14(17-9-18-15)19-11-3-1-2-4-11/h5-9,11H,1-4H2,(H,21,24)(H2,17,18,19,20)