[2-(nitrooxymethyl)phenyl] (E)-3-phenylprop-2-enoate

Systemtic Name: [2-(nitrooxymethyl)phenyl] (E)-3-phenylprop-2-enoate Openeye Name: [2-(nitrooxymethyl)phenyl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [2-(nitrooxymethyl)phenyl] ester IUPAC Name: [2-(nitrooxymethyl)phenyl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [2-(nitrooxymethyl)phenyl] ester Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)OC2=CC=CC=C2CO[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)OC2=CC=CC=C2CO[N+](=O)[O-]

InChI

InChI=1S/C16H13NO5/c18-16(11-10-13-6-2-1-3-7-13)22-15-9-5-4-8-14(15)12-21-17(19)20/h1-11H,12H2/b11-10+