[(2S)-1-oxidanylidene-1-[[2,4,5-tris(chloranyl)phenyl]amino]propan-2-yl] (2E,4E)-hexa-2,4-dienoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[[2,4,5-tris(chloranyl)phenyl]amino]propan-2-yl] (2E,4E)-hexa-2,4-dienoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(2,4,5-trichloroanilino)ethyl] (2E,4E)-hexa-2,4-dienoate CAS Name: (2E,4E)-hexa-2,4-dienoic acid [(2S)-1-oxo-1-(2,4,5-trichloroanilino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(2,4,5-trichloroanilino)propan-2-yl] (2E,4E)-hexa-2,4-dienoate Traditional Name: (2E,4E)-hexa-2,4-dienoic acid [(1S)-2-keto-1-methyl-2-(2,4,5-trichloroanilino)ethyl] ester Formula: C15H14Cl3NO3 MolecularWeight: 362.63556

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)OC(C)C(=O)NC1=CC(=C(C=C1Cl)Cl)Cl

Isomeric SMILES

C/C=C/C=C/C(=O)O[C@@H](C)C(=O)NC1=CC(=C(C=C1Cl)Cl)Cl

InChI

InChI=1S/C15H14Cl3NO3/c1-3-4-5-6-14(20)22-9(2)15(21)19-13-8-11(17)10(16)7-12(13)18/h3-9H,1-2H3,(H,19,21)/b4-3+,6-5+/t9-/m0/s1