2-(1H-benzimidazol-2-yl)-5-(2-methoxy-2-oxidanylidene-ethyl)pyrazol-3-olate

Systemtic Name: 2-(1H-benzimidazol-2-yl)-5-(2-methoxy-2-oxidanylidene-ethyl)pyrazol-3-olate Openeye Name: 2-(1H-benzimidazol-2-yl)-5-(2-methoxy-2-oxo-ethyl)pyrazol-3-olate CAS Name: 2-(1H-benzimidazol-2-yl)-5-(2-methoxy-2-oxoethyl)-3-pyrazololate IUPAC Name: 2-(1H-benzimidazol-2-yl)-5-(2-methoxy-2-oxoethyl)pyrazol-3-olate Traditional Name: 2-(1H-benzimidazol-2-yl)-5-(2-keto-2-methoxy-ethyl)pyrazol-3-olate Formula: C13H11N4O3- MolecularWeight: 271.25144

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=NN(C(=C1)[O-])C2=NC3=CC=CC=C3N2

Isomeric SMILES

COC(=O)CC1=NN(C(=C1)[O-])C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C13H12N4O3/c1-20-12(19)7-8-6-11(18)17(16-8)13-14-9-4-2-3-5-10(9)15-13/h2-6,18H,7H2,1H3,(H,14,15)/p-1