(3-cyanophenyl)methyl 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: (3-cyanophenyl)methyl 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: (3-cyanophenyl)methyl 1-butyl-6-oxo-pyridazine-3-carboxylate CAS Name: 1-butyl-6-oxo-3-pyridazinecarboxylic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 1-butyl-6-oxopyridazine-3-carboxylate Traditional Name: 1-butyl-6-keto-pyridazine-3-carboxylic acid (3-cyanobenzyl) ester Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=CC(=N1)C(=O)OCC2=CC=CC(=C2)C#N

Isomeric SMILES

CCCCN1C(=O)C=CC(=N1)C(=O)OCC2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H17N3O3/c1-2-3-9-20-16(21)8-7-15(19-20)17(22)23-12-14-6-4-5-13(10-14)11-18/h4-8,10H,2-3,9,12H2,1H3