[2-cyano-1-(3-methoxy-2-nitro-phenyl)prop-2-enyl] ethanoate

Systemtic Name: [2-cyano-1-(3-methoxy-2-nitro-phenyl)prop-2-enyl] ethanoate Openeye Name: [2-cyano-1-(3-methoxy-2-nitro-phenyl)allyl] acetate CAS Name: acetic acid [2-cyano-1-(3-methoxy-2-nitrophenyl)prop-2-enyl] ester IUPAC Name: [2-cyano-1-(3-methoxy-2-nitrophenyl)prop-2-enyl] acetate Traditional Name: acetic acid [2-cyano-1-(3-methoxy-2-nitro-phenyl)allyl] ester Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O5/c1-8(7-14)13(20-9(2)16)10-5-4-6-11(19-3)12(10)15(17)18/h4-6,13H,1H2,2-3H3