[2-methoxy-5-[(E)-2-nitroprop-1-enyl]phenyl] ethanoate

Systemtic Name: [2-methoxy-5-[(E)-2-nitroprop-1-enyl]phenyl] ethanoate Openeye Name: [2-methoxy-5-[(E)-2-nitroprop-1-enyl]phenyl] acetate CAS Name: acetic acid [2-methoxy-5-[(E)-2-nitroprop-1-enyl]phenyl] ester IUPAC Name: [2-methoxy-5-[(E)-2-nitroprop-1-enyl]phenyl] acetate Traditional Name: acetic acid [2-methoxy-5-[(E)-2-nitroprop-1-enyl]phenyl] ester Formula: C12H13NO5 MolecularWeight: 251.23532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO5/c1-8(13(15)16)6-10-4-5-11(17-3)12(7-10)18-9(2)14/h4-7H,1-3H3/b8-6+