4-[3-(2-ethoxy-2-oxidanylidene-ethyl)-5-oxidanidyl-pyrazol-1-yl]benzoate

Systemtic Name: 4-[3-(2-ethoxy-2-oxidanylidene-ethyl)-5-oxidanidyl-pyrazol-1-yl]benzoate Openeye Name: 4-[3-(2-ethoxy-2-oxo-ethyl)-5-oxido-pyrazol-1-yl]benzoate CAS Name: 4-[3-(2-ethoxy-2-oxoethyl)-5-oxido-1-pyrazolyl]benzoate IUPAC Name: 4-[3-(2-ethoxy-2-oxoethyl)-5-oxidopyrazol-1-yl]benzoate Traditional Name: 4-[3-(2-ethoxy-2-keto-ethyl)-5-oxido-pyrazol-1-yl]benzoate Formula: C14H12N2O5-2 MolecularWeight: 288.25548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN(C(=C1)[O-])C2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CCOC(=O)CC1=NN(C(=C1)[O-])C2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C14H14N2O5/c1-2-21-13(18)8-10-7-12(17)16(15-10)11-5-3-9(4-6-11)14(19)20/h3-7,17H,2,8H2,1H3,(H,19,20)/p-2