ethyl 5-oxidanylidene-2-[(4-phenoxyphenyl)methyl]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-oxidanylidene-2-[(4-phenoxyphenyl)methyl]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-oxo-2-[(4-phenoxyphenyl)methyl]-1H-pyrazole-4-carboxylate CAS Name: 5-oxo-2-[(4-phenoxyphenyl)methyl]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-oxo-2-[(4-phenoxyphenyl)methyl]-1H-pyrazole-4-carboxylate Traditional Name: 3-keto-1-(4-phenoxybenzyl)-3-pyrazoline-4-carboxylic acid ethyl ester Formula: C19H18N2O4 MolecularWeight: 338.35722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(NC1=O)CC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CN(NC1=O)CC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O4/c1-2-24-19(23)17-13-21(20-18(17)22)12-14-8-10-16(11-9-14)25-15-6-4-3-5-7-15/h3-11,13H,2,12H2,1H3,(H,20,22)