(3-cyanophenyl)methyl 6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxylate

Systemtic Name: (3-cyanophenyl)methyl 6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxylate Openeye Name: (3-cyanophenyl)methyl 6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxylate CAS Name: 6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxylic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxylate Traditional Name: 6-keto-1-(2-phenoxyethyl)pyridazine-3-carboxylic acid (3-cyanobenzyl) ester Formula: C21H17N3O4 MolecularWeight: 375.37738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCN2C(=O)C=CC(=N2)C(=O)OCC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)OCCN2C(=O)C=CC(=N2)C(=O)OCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H17N3O4/c22-14-16-5-4-6-17(13-16)15-28-21(26)19-9-10-20(25)24(23-19)11-12-27-18-7-2-1-3-8-18/h1-10,13H,11-12,15H2