2-(1H-benzimidazol-2-yl)-5-methyl-4-[(1R)-3-oxidanylidene-1H-2-benzofuran-1-yl]pyrazol-3-olate

Systemtic Name: 2-(1H-benzimidazol-2-yl)-5-methyl-4-[(1R)-3-oxidanylidene-1H-2-benzofuran-1-yl]pyrazol-3-olate Openeye Name: 2-(1H-benzimidazol-2-yl)-5-methyl-4-[(1R)-3-oxo-1H-isobenzofuran-1-yl]pyrazol-3-olate CAS Name: 2-(1H-benzimidazol-2-yl)-5-methyl-4-[(1R)-3-oxo-1H-isobenzofuran-1-yl]-3-pyrazololate IUPAC Name: 2-(1H-benzimidazol-2-yl)-5-methyl-4-[(1R)-3-oxo-1H-2-benzofuran-1-yl]pyrazol-3-olate Traditional Name: 2-(1H-benzimidazol-2-yl)-4-[(1R)-3-ketophthalan-1-yl]-5-methyl-pyrazol-3-olate Formula: C19H13N4O3- MolecularWeight: 345.33152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2C3=CC=CC=C3C(=O)O2)[O-])C4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=NN(C(=C1[C@H]2C3=CC=CC=C3C(=O)O2)[O-])C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C19H14N4O3/c1-10-15(16-11-6-2-3-7-12(11)18(25)26-16)17(24)23(22-10)19-20-13-8-4-5-9-14(13)21-19/h2-9,16,24H,1H3,(H,20,21)/p-1/t16-/m1/s1