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

Systemtic Name: (2R)-2-(4-dimethylaminophenyl)-1-[2-(dimethylazaniumyl)ethyl]-3-ethanoyl-5-oxidanylidene-2H-pyrrol-4-olate Openeye Name: (2R)-3-acetyl-2-(4-dimethylaminophenyl)-1-[2-(dimethylammonio)ethyl]-5-oxo-2H-pyrrol-4-olate CAS Name: (2R)-3-acetyl-2-(4-dimethylaminophenyl)-1-[2-(dimethylammonio)ethyl]-5-oxo-2H-pyrrol-4-olate IUPAC Name: (2R)-3-acetyl-2-(4-dimethylaminophenyl)-1-[2-(dimethylazaniumyl)ethyl]-5-oxo-2H-pyrrol-4-olate Traditional Name: (5R)-4-acetyl-5-(4-dimethylaminophenyl)-1-[2-(dimethylammonio)ethyl]-2-keto-3-pyrrolin-3-olate Formula: C18H25N3O3 MolecularWeight: 331.4094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O3/c1-12(22)15-16(13-6-8-14(9-7-13)20(4)5)21(11-10-19(2)3)18(24)17(15)23/h6-9,16,23H,10-11H2,1-5H3/t16-/m1/s1