methyl (E)-4-oxidanylidene-4-[[2,2,2-tris(chloranyl)-1-oxidanyl-ethyl]amino]but-2-enoate

Systemtic Name: methyl (E)-4-oxidanylidene-4-[[2,2,2-tris(chloranyl)-1-oxidanyl-ethyl]amino]but-2-enoate Openeye Name: methyl (E)-4-oxo-4-[(2,2,2-trichloro-1-hydroxy-ethyl)amino]but-2-enoate CAS Name: (E)-4-oxo-4-[(2,2,2-trichloro-1-hydroxyethyl)amino]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-oxo-4-[(2,2,2-trichloro-1-hydroxyethyl)amino]but-2-enoate Traditional Name: (E)-4-keto-4-[(2,2,2-trichloro-1-hydroxy-ethyl)amino]but-2-enoic acid methyl ester Formula: C7H8Cl3NO4 MolecularWeight: 276.50172

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(=O)NC(C(Cl)(Cl)Cl)O

Isomeric SMILES

COC(=O)/C=C/C(=O)NC(C(Cl)(Cl)Cl)O

InChI

InChI=1S/C7H8Cl3NO4/c1-15-5(13)3-2-4(12)11-6(14)7(8,9)10/h2-3,6,14H,1H3,(H,11,12)/b3-2+