methyl 5-cyano-4-[(E)-2-(dimethylamino)ethenyl]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: methyl 5-cyano-4-[(E)-2-(dimethylamino)ethenyl]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: methyl 5-cyano-4-[(E)-2-(dimethylamino)vinyl]-1-(4-fluorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 5-cyano-4-[(E)-2-(dimethylamino)ethenyl]-1-(4-fluorophenyl)-6-oxo-3-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 5-cyano-4-[(E)-2-(dimethylamino)ethenyl]-1-(4-fluorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 5-cyano-4-[(E)-2-(dimethylamino)vinyl]-1-(4-fluorophenyl)-6-keto-pyridazine-3-carboxylic acid methyl ester Formula: C17H15FN4O3 MolecularWeight: 342.324403

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=CC1=C(C(=O)N(N=C1C(=O)OC)C2=CC=C(C=C2)F)C#N

Isomeric SMILES

CN(C)/C=C/C1=C(C(=O)N(N=C1C(=O)OC)C2=CC=C(C=C2)F)C#N

InChI

InChI=1S/C17H15FN4O3/c1-21(2)9-8-13-14(10-19)16(23)22(20-15(13)17(24)25-3)12-6-4-11(18)5-7-12/h4-9H,1-3H3/b9-8+