2-[2-[(5-nitro-2-oxidanidyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-6-propyl-pyrimidin-4-olate

Systemtic Name: 2-[2-[(5-nitro-2-oxidanidyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-6-propyl-pyrimidin-4-olate Openeye Name: 2-[2-[(5-nitro-2-oxido-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-6-propyl-pyrimidin-4-olate CAS Name: 2-[(5-nitro-2-oxido-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-6-propyl-4-pyrimidinolate IUPAC Name: 2-[2-[(5-nitro-2-oxido-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-6-propylpyrimidin-4-olate Traditional Name: 2-[N'-[(4-keto-5-nitro-2-oxido-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-6-propyl-pyrimidin-4-olate Formula: C14H13N5O5-2 MolecularWeight: 331.28352

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=N1)NNC=C2C=C(C(=O)C=C2[O-])[N+](=O)[O-])[O-]

Isomeric SMILES

CCCC1=CC(=NC(=N1)NNC=C2C=C(C(=O)C=C2[O-])[N+](=O)[O-])[O-]

InChI

InChI=1S/C14H15N5O5/c1-2-3-9-5-13(22)17-14(16-9)18-15-7-8-4-10(19(23)24)12(21)6-11(8)20/h4-7,15,20H,2-3H2,1H3,(H2,16,17,18,22)/p-2