(4-pyrazol-1-ylphenyl)methyl 6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxylate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxylate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxylate CAS Name: 6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxylic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxylate Traditional Name: 6-keto-1-(2-phenoxyethyl)pyridazine-3-carboxylic acid (4-pyrazol-1-ylbenzyl) ester Formula: C23H20N4O4 MolecularWeight: 416.4293

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCN2C(=O)C=CC(=N2)C(=O)OCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)OCCN2C(=O)C=CC(=N2)C(=O)OCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C23H20N4O4/c28-22-12-11-21(25-27(22)15-16-30-20-5-2-1-3-6-20)23(29)31-17-18-7-9-19(10-8-18)26-14-4-13-24-26/h1-14H,15-17H2