[(E)-2-nitro-3-phenyl-prop-2-enyl] propanoate

Systemtic Name: [(E)-2-nitro-3-phenyl-prop-2-enyl] propanoate Openeye Name: [(E)-2-nitro-3-phenyl-allyl] propanoate CAS Name: propanoic acid [(E)-2-nitro-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-2-nitro-3-phenylprop-2-enyl] propanoate Traditional Name: propionic acid [(E)-2-nitro-3-phenyl-allyl] ester Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO4/c1-2-12(14)17-9-11(13(15)16)8-10-6-4-3-5-7-10/h3-8H,2,9H2,1H3/b11-8+