(E)-3-[3-(hydroxymethyl)-4-nitro-phenyl]prop-2-enoate

Systemtic Name: (E)-3-[3-(hydroxymethyl)-4-nitro-phenyl]prop-2-enoate Openeye Name: (E)-3-[3-(hydroxymethyl)-4-nitro-phenyl]prop-2-enoate CAS Name: (E)-3-[3-(hydroxymethyl)-4-nitrophenyl]-2-propenoate IUPAC Name: (E)-3-[3-(hydroxymethyl)-4-nitrophenyl]prop-2-enoate Traditional Name: (E)-3-(3-methylol-4-nitro-phenyl)acrylate Formula: C10H8NO5- MolecularWeight: 222.17422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC(=O)[O-])CO)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO5/c12-6-8-5-7(2-4-10(13)14)1-3-9(8)11(15)16/h1-5,12H,6H2,(H,13,14)/p-1/b4-2+