2-[(2S)-3-ethanoyl-4-oxidanyl-5-oxidanylidene-2-phenyl-2H-pyrrol-1-yl]ethylazanium

Systemtic Name: 2-[(2S)-3-ethanoyl-4-oxidanyl-5-oxidanylidene-2-phenyl-2H-pyrrol-1-yl]ethylazanium Openeye Name: 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]ethylammonium CAS Name: 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]ethylammonium IUPAC Name: 2-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]ethylazanium Traditional Name: 2-[(5S)-4-acetyl-3-hydroxy-2-keto-5-phenyl-3-pyrrolin-1-yl]ethylammonium Formula: C14H17N2O3+ MolecularWeight: 261.29638

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2=CC=CC=C2)CC[NH3+])O

Isomeric SMILES

CC(=O)C1=C(C(=O)N([C@H]1C2=CC=CC=C2)CC[NH3+])O

InChI

InChI=1S/C14H16N2O3/c1-9(17)11-12(10-5-3-2-4-6-10)16(8-7-15)14(19)13(11)18/h2-6,12,18H,7-8,15H2,1H3/p+1/t12-/m0/s1