(2S)-3-ethanoyl-1-[2-(2-hydroxyethylazaniumyl)ethyl]-5-oxidanylidene-2-phenyl-2H-pyrrol-4-olate

Systemtic Name: (2S)-3-ethanoyl-1-[2-(2-hydroxyethylazaniumyl)ethyl]-5-oxidanylidene-2-phenyl-2H-pyrrol-4-olate Openeye Name: (2S)-3-acetyl-1-[2-(2-hydroxyethylammonio)ethyl]-5-oxo-2-phenyl-2H-pyrrol-4-olate CAS Name: (2S)-3-acetyl-1-[2-(2-hydroxyethylammonio)ethyl]-5-oxo-2-phenyl-2H-pyrrol-4-olate IUPAC Name: (2S)-3-acetyl-1-[2-(2-hydroxyethylazaniumyl)ethyl]-5-oxo-2-phenyl-2H-pyrrol-4-olate Traditional Name: (5S)-4-acetyl-1-[2-(2-hydroxyethylammonio)ethyl]-2-keto-5-phenyl-3-pyrrolin-3-olate Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2=CC=CC=C2)CC[NH2+]CCO)[O-]

Isomeric SMILES

CC(=O)C1=C(C(=O)N([C@H]1C2=CC=CC=C2)CC[NH2+]CCO)[O-]

InChI

InChI=1S/C16H20N2O4/c1-11(20)13-14(12-5-3-2-4-6-12)18(16(22)15(13)21)9-7-17-8-10-19/h2-6,14,17,19,21H,7-10H2,1H3/t14-/m0/s1