ethyl (2S)-3-bromanyl-1-(4-chlorophenyl)-2-methyl-4-oxidanyl-5-oxidanylidene-pyrrole-2-carboxylate

Systemtic Name: ethyl (2S)-3-bromanyl-1-(4-chlorophenyl)-2-methyl-4-oxidanyl-5-oxidanylidene-pyrrole-2-carboxylate Openeye Name: ethyl (2S)-3-bromo-1-(4-chlorophenyl)-4-hydroxy-2-methyl-5-oxo-pyrrole-2-carboxylate CAS Name: (2S)-3-bromo-1-(4-chlorophenyl)-4-hydroxy-2-methyl-5-oxo-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (2S)-3-bromo-1-(4-chlorophenyl)-4-hydroxy-2-methyl-5-oxopyrrole-2-carboxylate Traditional Name: (2S)-3-bromo-1-(4-chlorophenyl)-4-hydroxy-5-keto-2-methyl-3-pyrroline-2-carboxylic acid ethyl ester Formula: C14H13BrClNO4 MolecularWeight: 374.61432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=C(C(=O)N1C2=CC=C(C=C2)Cl)O)Br)C

Isomeric SMILES

CCOC(=O)[C@]1(C(=C(C(=O)N1C2=CC=C(C=C2)Cl)O)Br)C

InChI

InChI=1S/C14H13BrClNO4/c1-3-21-13(20)14(2)11(15)10(18)12(19)17(14)9-6-4-8(16)5-7-9/h4-7,18H,3H2,1-2H3/t14-/m1/s1