(2R)-3-(1-benzofuran-2-ylcarbonyl)-1-(3-imidazol-1-ylpropyl)-2-(4-methylphenyl)-5-oxidanylidene-2H-pyrrol-4-olate

Systemtic Name: (2R)-3-(1-benzofuran-2-ylcarbonyl)-1-(3-imidazol-1-ylpropyl)-2-(4-methylphenyl)-5-oxidanylidene-2H-pyrrol-4-olate Openeye Name: (2R)-3-(benzofuran-2-carbonyl)-1-(3-imidazol-1-ylpropyl)-5-oxo-2-(p-tolyl)-2H-pyrrol-4-olate CAS Name: (2R)-3-[2-benzofuranyl(oxo)methyl]-1-[3-(1-imidazolyl)propyl]-2-(4-methylphenyl)-5-oxo-2H-pyrrol-4-olate IUPAC Name: (2R)-3-(1-benzofuran-2-carbonyl)-1-(3-imidazol-1-ylpropyl)-2-(4-methylphenyl)-5-oxo-2H-pyrrol-4-olate Traditional Name: (5R)-4-(benzofuran-2-carbonyl)-1-(3-imidazol-1-ylpropyl)-2-keto-5-(p-tolyl)-3-pyrrolin-3-olate Formula: C26H22N3O4- MolecularWeight: 440.47058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)[O-])C(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]2C(=C(C(=O)N2CCCN3C=CN=C3)[O-])C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C26H23N3O4/c1-17-7-9-18(10-8-17)23-22(24(30)21-15-19-5-2-3-6-20(19)33-21)25(31)26(32)29(23)13-4-12-28-14-11-27-16-28/h2-3,5-11,14-16,23,31H,4,12-13H2,1H3/p-1/t23-/m1/s1