ethyl 4-[2-fluoranyl-4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-fluoranyl-4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-fluoro-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]piperazine-1-carboxylate CAS Name: 4-[2-fluoro-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-fluoro-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-fluoro-4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)phenyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H23FN4O3 MolecularWeight: 362.398623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C3=NNC(=O)CC3C)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C3=NNC(=O)CC3C)F

InChI

InChI=1S/C18H23FN4O3/c1-3-26-18(25)23-8-6-22(7-9-23)15-5-4-13(11-14(15)19)17-12(2)10-16(24)20-21-17/h4-5,11-12H,3,6-10H2,1-2H3,(H,20,24)