methyl (E)-2-nitro-3-oxidanyl-prop-2-enoate

Systemtic Name: methyl (E)-2-nitro-3-oxidanyl-prop-2-enoate Openeye Name: methyl (E)-3-hydroxy-2-nitro-prop-2-enoate CAS Name: (E)-3-hydroxy-2-nitro-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-hydroxy-2-nitroprop-2-enoate Traditional Name: (E)-3-hydroxy-2-nitro-acrylic acid methyl ester Formula: C4H5NO5 MolecularWeight: 147.0862

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CO)[N+](=O)[O-]

Isomeric SMILES

COC(=O)/C(=C\O)/[N+](=O)[O-]

InChI

InChI=1S/C4H5NO5/c1-10-4(7)3(2-6)5(8)9/h2,6H,1H3/b3-2+