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

Systemtic Name: [3-(hydroxymethyl)-4-nitro-phenyl] (E)-2-(azanyloxymethyl)-3-phenyl-prop-2-enoate Openeye Name: [3-(hydroxymethyl)-4-nitro-phenyl] (E)-2-(aminooxymethyl)-3-phenyl-prop-2-enoate CAS Name: (E)-2-(aminooxymethyl)-3-phenyl-2-propenoic acid [3-(hydroxymethyl)-4-nitrophenyl] ester IUPAC Name: [3-(hydroxymethyl)-4-nitrophenyl] (E)-2-(aminooxymethyl)-3-phenylprop-2-enoate Traditional Name: (E)-2-(aminooxymethyl)-3-phenyl-acrylic acid (3-methylol-4-nitro-phenyl) ester Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C(CON)C(=O)OC2=CC(=C(C=C2)[N+](=O)[O-])CO

Isomeric SMILES

C1=CC=C(C=C1)/C=C(\CON)/C(=O)OC2=CC(=C(C=C2)[N+](=O)[O-])CO

InChI

InChI=1S/C17H16N2O6/c18-24-11-14(8-12-4-2-1-3-5-12)17(21)25-15-6-7-16(19(22)23)13(9-15)10-20/h1-9,20H,10-11,18H2/b14-8+