ethyl (2S)-1-(4-bromophenyl)-2-methyl-4-oxidanyl-5-oxidanylidene-pyrrole-2-carboxylate

Systemtic Name: ethyl (2S)-1-(4-bromophenyl)-2-methyl-4-oxidanyl-5-oxidanylidene-pyrrole-2-carboxylate Openeye Name: ethyl (2S)-1-(4-bromophenyl)-4-hydroxy-2-methyl-5-oxo-pyrrole-2-carboxylate CAS Name: (2S)-1-(4-bromophenyl)-4-hydroxy-2-methyl-5-oxo-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (2S)-1-(4-bromophenyl)-4-hydroxy-2-methyl-5-oxopyrrole-2-carboxylate Traditional Name: (2S)-1-(4-bromophenyl)-4-hydroxy-5-keto-2-methyl-3-pyrroline-2-carboxylic acid ethyl ester Formula: C14H14BrNO4 MolecularWeight: 340.16926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14BrNO4/c1-3-20-13(19)14(2)8-11(17)12(18)16(14)10-6-4-9(15)5-7-10/h4-8,17H,3H2,1-2H3/t14-/m0/s1