ethyl 4-(3-oxidanylidene-5-phenyl-1H-pyrazol-2-yl)benzoate

Systemtic Name: ethyl 4-(3-oxidanylidene-5-phenyl-1H-pyrazol-2-yl)benzoate Openeye Name: ethyl 4-(3-oxo-5-phenyl-1H-pyrazol-2-yl)benzoate CAS Name: 4-(3-oxo-5-phenyl-1H-pyrazol-2-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(3-oxo-5-phenyl-1H-pyrazol-2-yl)benzoate Traditional Name: 4-(5-keto-3-phenyl-3-pyrazolin-1-yl)benzoic acid ethyl ester Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C=C(N2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O3/c1-2-23-18(22)14-8-10-15(11-9-14)20-17(21)12-16(19-20)13-6-4-3-5-7-13/h3-12,19H,2H2,1H3