(E)-2-(4-nitropyrazol-1-yl)-3-oxidanyl-prop-2-enal

Systemtic Name: (E)-2-(4-nitropyrazol-1-yl)-3-oxidanyl-prop-2-enal Openeye Name: (E)-3-hydroxy-2-(4-nitropyrazol-1-yl)prop-2-enal CAS Name: (E)-3-hydroxy-2-(4-nitro-1-pyrazolyl)-2-propenal IUPAC Name: (E)-3-hydroxy-2-(4-nitropyrazol-1-yl)prop-2-enal Traditional Name: (E)-3-hydroxy-2-(4-nitropyrazol-1-yl)acrolein Formula: C6H5N3O4 MolecularWeight: 183.1216

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NN1C(=CO)C=O)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=NN1/C(=C/O)/C=O)[N+](=O)[O-]

InChI

InChI=1S/C6H5N3O4/c10-3-6(4-11)8-2-5(1-7-8)9(12)13/h1-4,10H/b6-3+