(2R)-3-(1-benzofuran-2-ylcarbonyl)-1-[3-(dimethylazaniumyl)propyl]-5-oxidanylidene-2-pyridin-4-yl-2H-pyrrol-4-olate

Systemtic Name: (2R)-3-(1-benzofuran-2-ylcarbonyl)-1-[3-(dimethylazaniumyl)propyl]-5-oxidanylidene-2-pyridin-4-yl-2H-pyrrol-4-olate Openeye Name: (2R)-3-(benzofuran-2-carbonyl)-1-[3-(dimethylammonio)propyl]-5-oxo-2-(4-pyridyl)-2H-pyrrol-4-olate CAS Name: (2R)-3-[2-benzofuranyl(oxo)methyl]-1-[3-(dimethylammonio)propyl]-5-oxo-2-pyridin-4-yl-2H-pyrrol-4-olate IUPAC Name: (2R)-3-(1-benzofuran-2-carbonyl)-1-[3-(dimethylazaniumyl)propyl]-5-oxo-2-pyridin-4-yl-2H-pyrrol-4-olate Traditional Name: (5R)-4-(benzofuran-2-carbonyl)-1-[3-(dimethylammonio)propyl]-2-keto-5-(4-pyridyl)-3-pyrrolin-3-olate Formula: C23H23N3O4 MolecularWeight: 405.44642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C(C(=C(C1=O)[O-])C(=O)C2=CC3=CC=CC=C3O2)C4=CC=NC=C4

Isomeric SMILES

C[NH+](C)CCCN1[C@@H](C(=C(C1=O)[O-])C(=O)C2=CC3=CC=CC=C3O2)C4=CC=NC=C4

InChI

InChI=1S/C23H23N3O4/c1-25(2)12-5-13-26-20(15-8-10-24-11-9-15)19(22(28)23(26)29)21(27)18-14-16-6-3-4-7-17(16)30-18/h3-4,6-11,14,20,28H,5,12-13H2,1-2H3/t20-/m1/s1