2,2,2-tris(chloranyl)ethyl (E)-3-azanyl-3-bromanyl-2-cyano-prop-2-enoate

Systemtic Name: 2,2,2-tris(chloranyl)ethyl (E)-3-azanyl-3-bromanyl-2-cyano-prop-2-enoate Openeye Name: 2,2,2-trichloroethyl (E)-3-amino-3-bromo-2-cyano-prop-2-enoate CAS Name: (E)-3-amino-3-bromo-2-cyano-2-propenoic acid 2,2,2-trichloroethyl ester IUPAC Name: 2,2,2-trichloroethyl (E)-3-amino-3-bromo-2-cyanoprop-2-enoate Traditional Name: (E)-3-amino-3-bromo-2-cyano-acrylic acid 2,2,2-trichloroethyl ester Formula: C6H4BrCl3N2O2 MolecularWeight: 322.37116

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Descriptors Computed from Structure

Canonical SMILES:

C(C(Cl)(Cl)Cl)OC(=O)C(=C(N)Br)C#N

Isomeric SMILES

C(C(Cl)(Cl)Cl)OC(=O)/C(=C(\N)/Br)/C#N

InChI

InChI=1S/C6H4BrCl3N2O2/c7-4(12)3(1-11)5(13)14-2-6(8,9)10/h2,12H2/b4-3-