ethyl 4-[(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)amino]benzoate

Systemtic Name: ethyl 4-[(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)amino]benzoate Openeye Name: ethyl 4-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]benzoate CAS Name: 4-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]benzoate Traditional Name: 4-[(5-keto-1-phenyl-2-pyrazolin-3-yl)amino]benzoic acid ethyl ester Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NN(C(=O)C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NN(C(=O)C2)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O3/c1-2-24-18(23)13-8-10-14(11-9-13)19-16-12-17(22)21(20-16)15-6-4-3-5-7-15/h3-11H,2,12H2,1H3,(H,19,20)