ethyl (E)-3-(4-bromanyl-3-nitro-phenyl)-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-(4-bromanyl-3-nitro-phenyl)-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-(4-bromo-3-nitro-phenyl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(4-bromo-3-nitrophenyl)-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(4-bromo-3-nitrophenyl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(4-bromo-3-nitro-phenyl)-2-cyano-acrylic acid ethyl ester Formula: C12H9BrN2O4 MolecularWeight: 325.11486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C=C1)Br)[N+](=O)[O-])C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=C(C=C1)Br)[N+](=O)[O-])/C#N

InChI

InChI=1S/C12H9BrN2O4/c1-2-19-12(16)9(7-14)5-8-3-4-10(13)11(6-8)15(17)18/h3-6H,2H2,1H3/b9-5+