2-[(2S)-3-ethanoyl-2-(3-fluorophenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]ethyl-diethyl-azanium

Systemtic Name: 2-[(2S)-3-ethanoyl-2-(3-fluorophenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]ethyl-diethyl-azanium Openeye Name: 2-[(2S)-3-acetyl-2-(3-fluorophenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]ethyl-diethyl-ammonium CAS Name: 2-[(2S)-3-acetyl-2-(3-fluorophenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]ethyl-diethylammonium IUPAC Name: 2-[(2S)-3-acetyl-2-(3-fluorophenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]ethyl-diethylazanium Traditional Name: 2-[(2S)-3-acetyl-2-(3-fluorophenyl)-4-hydroxy-5-keto-3-pyrrolin-1-yl]ethyl-diethyl-ammonium Formula: C18H24FN2O3+ MolecularWeight: 335.393163

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(C(=C(C1=O)O)C(=O)C)C2=CC(=CC=C2)F

Isomeric SMILES

CC[NH+](CC)CCN1[C@H](C(=C(C1=O)O)C(=O)C)C2=CC(=CC=C2)F

InChI

InChI=1S/C18H23FN2O3/c1-4-20(5-2)9-10-21-16(13-7-6-8-14(19)11-13)15(12(3)22)17(23)18(21)24/h6-8,11,16,23H,4-5,9-10H2,1-3H3/p+1/t16-/m0/s1