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

Systemtic Name: (2R)-1-[2-(dimethylazaniumyl)ethyl]-3-ethanoyl-5-oxidanylidene-2-(4-propan-2-ylphenyl)-2H-pyrrol-4-olate Openeye Name: (2R)-3-acetyl-1-[2-(dimethylammonio)ethyl]-2-(4-isopropylphenyl)-5-oxo-2H-pyrrol-4-olate CAS Name: (2R)-3-acetyl-1-[2-(dimethylammonio)ethyl]-5-oxo-2-(4-propan-2-ylphenyl)-2H-pyrrol-4-olate IUPAC Name: (2R)-3-acetyl-1-[2-(dimethylazaniumyl)ethyl]-5-oxo-2-(4-propan-2-ylphenyl)-2H-pyrrol-4-olate Traditional Name: (5R)-4-acetyl-1-[2-(dimethylammonio)ethyl]-2-keto-5-p-cumenyl-3-pyrrolin-3-olate Formula: C19H26N2O3 MolecularWeight: 330.42134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O3/c1-12(2)14-6-8-15(9-7-14)17-16(13(3)22)18(23)19(24)21(17)11-10-20(4)5/h6-9,12,17,23H,10-11H2,1-5H3/t17-/m1/s1