[(E)-2-nitro-3-(3,4,5-trimethoxyphenyl)prop-2-enyl] ethanoate

Systemtic Name: [(E)-2-nitro-3-(3,4,5-trimethoxyphenyl)prop-2-enyl] ethanoate Openeye Name: [(E)-2-nitro-3-(3,4,5-trimethoxyphenyl)allyl] acetate CAS Name: acetic acid [(E)-2-nitro-3-(3,4,5-trimethoxyphenyl)prop-2-enyl] ester IUPAC Name: [(E)-2-nitro-3-(3,4,5-trimethoxyphenyl)prop-2-enyl] acetate Traditional Name: acetic acid [(E)-2-nitro-3-(3,4,5-trimethoxyphenyl)allyl] ester Formula: C14H17NO7 MolecularWeight: 311.28728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO7/c1-9(16)22-8-11(15(17)18)5-10-6-12(19-2)14(21-4)13(7-10)20-3/h5-7H,8H2,1-4H3/b11-5+