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

Systemtic Name: propan-2-yl (E)-3,4,4-tris(chloranyl)-2-nitro-but-2-enoate Openeye Name: isopropyl (E)-3,4,4-trichloro-2-nitro-but-2-enoate CAS Name: (E)-3,4,4-trichloro-2-nitro-2-butenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-3,4,4-trichloro-2-nitrobut-2-enoate Traditional Name: (E)-3,4,4-trichloro-2-nitro-but-2-enoic acid isopropyl ester Formula: C7H8Cl3NO4 MolecularWeight: 276.50172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8Cl3NO4/c1-3(2)15-7(12)5(11(13)14)4(8)6(9)10/h3,6H,1-2H3/b5-4+