[(E)-3-(4-methoxyphenyl)-2-nitro-prop-2-enyl] ethanoate

Systemtic Name: [(E)-3-(4-methoxyphenyl)-2-nitro-prop-2-enyl] ethanoate Openeye Name: [(E)-3-(4-methoxyphenyl)-2-nitro-allyl] acetate CAS Name: acetic acid [(E)-3-(4-methoxyphenyl)-2-nitroprop-2-enyl] ester IUPAC Name: [(E)-3-(4-methoxyphenyl)-2-nitroprop-2-enyl] acetate Traditional Name: acetic acid [(E)-3-(4-methoxyphenyl)-2-nitro-allyl] ester Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=CC1=CC=C(C=C1)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO5/c1-9(14)18-8-11(13(15)16)7-10-3-5-12(17-2)6-4-10/h3-7H,8H2,1-2H3/b11-7+