(2S)-2-(4-bromophenyl)-3-ethanoyl-1-[(2S)-2-ethylhexyl]-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: (2S)-2-(4-bromophenyl)-3-ethanoyl-1-[(2S)-2-ethylhexyl]-4-oxidanyl-2H-pyrrol-5-one Openeye Name: (2S)-3-acetyl-2-(4-bromophenyl)-1-[(2S)-2-ethylhexyl]-4-hydroxy-2H-pyrrol-5-one CAS Name: (2S)-3-acetyl-2-(4-bromophenyl)-1-[(2S)-2-ethylhexyl]-4-hydroxy-2H-pyrrol-5-one IUPAC Name: (2S)-3-acetyl-2-(4-bromophenyl)-1-[(2S)-2-ethylhexyl]-4-hydroxy-2H-pyrrol-5-one Traditional Name: (5S)-4-acetyl-5-(4-bromophenyl)-1-[(2S)-2-ethylhexyl]-3-hydroxy-3-pyrrolin-2-one Formula: C20H26BrNO3 MolecularWeight: 408.32934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN1C(C(=C(C1=O)O)C(=O)C)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCC[C@H](CC)CN1[C@H](C(=C(C1=O)O)C(=O)C)C2=CC=C(C=C2)Br

InChI

InChI=1S/C20H26BrNO3/c1-4-6-7-14(5-2)12-22-18(15-8-10-16(21)11-9-15)17(13(3)23)19(24)20(22)25/h8-11,14,18,24H,4-7,12H2,1-3H3/t14-,18-/m0/s1