4-(4-ethoxycarbonyl-5-oxidanylidene-3-phenyl-1H-pyrazol-2-yl)benzoic acid

Systemtic Name: 4-(4-ethoxycarbonyl-5-oxidanylidene-3-phenyl-1H-pyrazol-2-yl)benzoic acid Openeye Name: 4-(4-ethoxycarbonyl-5-oxo-3-phenyl-1H-pyrazol-2-yl)benzoic acid CAS Name: 4-(4-ethoxycarbonyl-5-oxo-3-phenyl-1H-pyrazol-2-yl)benzoic acid IUPAC Name: 4-(4-ethoxycarbonyl-5-oxo-3-phenyl-1H-pyrazol-2-yl)benzoic acid Traditional Name: 4-(4-carbethoxy-3-keto-5-phenyl-3-pyrazolin-1-yl)benzoic acid Formula: C19H16N2O5 MolecularWeight: 352.34074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(NC1=O)C2=CC=C(C=C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(NC1=O)C2=CC=C(C=C2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C19H16N2O5/c1-2-26-19(25)15-16(12-6-4-3-5-7-12)21(20-17(15)22)14-10-8-13(9-11-14)18(23)24/h3-11H,2H2,1H3,(H,20,22)(H,23,24)