[(2R)-1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: [(2R)-1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: [(1R)-2-(2-fluoroanilino)-1-methyl-2-oxo-ethyl] 1-butyl-6-oxo-pyridazine-3-carboxylate CAS Name: 1-butyl-6-oxo-3-pyridazinecarboxylic acid [(2R)-1-(2-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-fluoroanilino)-1-oxopropan-2-yl] 1-butyl-6-oxopyridazine-3-carboxylate Traditional Name: 1-butyl-6-keto-pyridazine-3-carboxylic acid [(1R)-2-(2-fluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C18H20FN3O4 MolecularWeight: 361.367503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=CC(=N1)C(=O)OC(C)C(=O)NC2=CC=CC=C2F

Isomeric SMILES

CCCCN1C(=O)C=CC(=N1)C(=O)O[C@H](C)C(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C18H20FN3O4/c1-3-4-11-22-16(23)10-9-15(21-22)18(25)26-12(2)17(24)20-14-8-6-5-7-13(14)19/h5-10,12H,3-4,11H2,1-2H3,(H,20,24)/t12-/m1/s1