(2R)-1-[2-(dimethylazaniumyl)ethyl]-3-ethanoyl-2-(4-ethoxyphenyl)-5-oxidanylidene-2H-pyrrol-4-olate

Systemtic Name: (2R)-1-[2-(dimethylazaniumyl)ethyl]-3-ethanoyl-2-(4-ethoxyphenyl)-5-oxidanylidene-2H-pyrrol-4-olate Openeye Name: (2R)-3-acetyl-1-[2-(dimethylammonio)ethyl]-2-(4-ethoxyphenyl)-5-oxo-2H-pyrrol-4-olate CAS Name: (2R)-3-acetyl-1-[2-(dimethylammonio)ethyl]-2-(4-ethoxyphenyl)-5-oxo-2H-pyrrol-4-olate IUPAC Name: (2R)-3-acetyl-1-[2-(dimethylazaniumyl)ethyl]-2-(4-ethoxyphenyl)-5-oxo-2H-pyrrol-4-olate Traditional Name: (5R)-4-acetyl-1-[2-(dimethylammonio)ethyl]-2-keto-5-p-phenetyl-3-pyrrolin-3-olate Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(=C(C(=O)N2CC[NH+](C)C)[O-])C(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@@H]2C(=C(C(=O)N2CC[NH+](C)C)[O-])C(=O)C

InChI

InChI=1S/C18H24N2O4/c1-5-24-14-8-6-13(7-9-14)16-15(12(2)21)17(22)18(23)20(16)11-10-19(3)4/h6-9,16,22H,5,10-11H2,1-4H3/t16-/m1/s1