methyl (E)-3,4,4-tris(chloranyl)-2-nitro-but-2-enoate

Systemtic Name: methyl (E)-3,4,4-tris(chloranyl)-2-nitro-but-2-enoate Openeye Name: methyl (E)-3,4,4-trichloro-2-nitro-but-2-enoate CAS Name: (E)-3,4,4-trichloro-2-nitro-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3,4,4-trichloro-2-nitrobut-2-enoate Traditional Name: (E)-3,4,4-trichloro-2-nitro-but-2-enoic acid methyl ester Formula: C5H4Cl3NO4 MolecularWeight: 248.44856

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C(C(Cl)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)/C(=C(/C(Cl)Cl)\Cl)/[N+](=O)[O-]

InChI

InChI=1S/C5H4Cl3NO4/c1-13-5(10)3(9(11)12)2(6)4(7)8/h4H,1H3/b3-2+