methyl (2S)-2-[3,4-bis(chloranyl)-5-oxidanylidene-2H-pyrrol-1-yl]-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-[3,4-bis(chloranyl)-5-oxidanylidene-2H-pyrrol-1-yl]-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-(3,4-dichloro-5-oxo-2H-pyrrol-1-yl)-2-phenyl-acetate CAS Name: (2S)-2-(3,4-dichloro-5-oxo-2H-pyrrol-1-yl)-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-(3,4-dichloro-5-oxo-2H-pyrrol-1-yl)-2-phenylacetate Traditional Name: (2S)-2-(3,4-dichloro-2-keto-3-pyrrolin-1-yl)-2-phenyl-acetic acid methyl ester Formula: C13H11Cl2NO3 MolecularWeight: 300.13734

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)N2CC(=C(C2=O)Cl)Cl

Isomeric SMILES

COC(=O)[C@H](C1=CC=CC=C1)N2CC(=C(C2=O)Cl)Cl

InChI

InChI=1S/C13H11Cl2NO3/c1-19-13(18)11(8-5-3-2-4-6-8)16-7-9(14)10(15)12(16)17/h2-6,11H,7H2,1H3/t11-/m0/s1