methyl 4-[(E)-[2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethoxy]iminomethyl]benzoate

Systemtic Name: methyl 4-[(E)-[2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethoxy]iminomethyl]benzoate Openeye Name: methyl 4-[(E)-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethoxy]iminomethyl]benzoate CAS Name: 4-[(E)-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethoxy]iminomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethoxy]iminomethyl]benzoate Traditional Name: 4-[(E)-[2-keto-2-(3-phenyl-2-pyrazolin-1-yl)ethyl]oximinomethyl]benzoic acid methyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=NOCC(=O)N2CCC(=N2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=N/OCC(=O)N2CCC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O4/c1-26-20(25)17-9-7-15(8-10-17)13-21-27-14-19(24)23-12-11-18(22-23)16-5-3-2-4-6-16/h2-10,13H,11-12,14H2,1H3/b21-13+