[(2R)-1-[(3-fluoranyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: [(2R)-1-[(3-fluoranyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: [(1R)-2-(3-fluoro-4-methyl-anilino)-1-methyl-2-oxo-ethyl] 1-butyl-6-oxo-pyridazine-3-carboxylate CAS Name: 1-butyl-6-oxo-3-pyridazinecarboxylic acid [(2R)-1-(3-fluoro-4-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(3-fluoro-4-methylanilino)-1-oxopropan-2-yl] 1-butyl-6-oxopyridazine-3-carboxylate Traditional Name: 1-butyl-6-keto-pyridazine-3-carboxylic acid [(1R)-2-(3-fluoro-4-methyl-anilino)-2-keto-1-methyl-ethyl] ester Formula: C19H22FN3O4 MolecularWeight: 375.394083

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=CC(=N1)C(=O)OC(C)C(=O)NC2=CC(=C(C=C2)C)F

Isomeric SMILES

CCCCN1C(=O)C=CC(=N1)C(=O)O[C@H](C)C(=O)NC2=CC(=C(C=C2)C)F

InChI

InChI=1S/C19H22FN3O4/c1-4-5-10-23-17(24)9-8-16(22-23)19(26)27-13(3)18(25)21-14-7-6-12(2)15(20)11-14/h6-9,11,13H,4-5,10H2,1-3H3,(H,21,25)/t13-/m1/s1