[2-bromanyl-6-methoxy-4-[(E)-2-nitroethenyl]phenyl] (E)-3-phenylprop-2-enoate

Systemtic Name: [2-bromanyl-6-methoxy-4-[(E)-2-nitroethenyl]phenyl] (E)-3-phenylprop-2-enoate Openeye Name: [2-bromo-6-methoxy-4-[(E)-2-nitrovinyl]phenyl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [2-bromo-6-methoxy-4-[(E)-2-nitroethenyl]phenyl] ester IUPAC Name: [2-bromo-6-methoxy-4-[(E)-2-nitroethenyl]phenyl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [2-bromo-6-methoxy-4-[(E)-2-nitrovinyl]phenyl] ester Formula: C18H14BrNO5 MolecularWeight: 404.21146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C[N+](=O)[O-])Br)OC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/[N+](=O)[O-])Br)OC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C18H14BrNO5/c1-24-16-12-14(9-10-20(22)23)11-15(19)18(16)25-17(21)8-7-13-5-3-2-4-6-13/h2-12H,1H3/b8-7+,10-9+