(2S)-1-(2-bromoethyl)-2-(2-chlorophenyl)-3-ethanoyl-5-oxidanylidene-2H-pyrrol-4-olate

Systemtic Name: (2S)-1-(2-bromoethyl)-2-(2-chlorophenyl)-3-ethanoyl-5-oxidanylidene-2H-pyrrol-4-olate Openeye Name: (2S)-3-acetyl-1-(2-bromoethyl)-2-(2-chlorophenyl)-5-oxo-2H-pyrrol-4-olate CAS Name: (2S)-3-acetyl-1-(2-bromoethyl)-2-(2-chlorophenyl)-5-oxo-2H-pyrrol-4-olate IUPAC Name: (2S)-3-acetyl-1-(2-bromoethyl)-2-(2-chlorophenyl)-5-oxo-2H-pyrrol-4-olate Traditional Name: (5S)-4-acetyl-1-(2-bromoethyl)-5-(2-chlorophenyl)-2-keto-3-pyrrolin-3-olate Formula: C14H12BrClNO3- MolecularWeight: 357.60698

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2=CC=CC=C2Cl)CCBr)[O-]

Isomeric SMILES

CC(=O)C1=C(C(=O)N([C@@H]1C2=CC=CC=C2Cl)CCBr)[O-]

InChI

InChI=1S/C14H13BrClNO3/c1-8(18)11-12(9-4-2-3-5-10(9)16)17(7-6-15)14(20)13(11)19/h2-5,12,19H,6-7H2,1H3/p-1/t12-/m1/s1