bis(2-methylpropyl) 2-(4-azanyl-3-fluoranyl-phenyl)-2-methyl-propanedioate

Systemtic Name: bis(2-methylpropyl) 2-(4-azanyl-3-fluoranyl-phenyl)-2-methyl-propanedioate Openeye Name: diisobutyl 2-(4-amino-3-fluoro-phenyl)-2-methyl-propanedioate CAS Name: 2-(4-amino-3-fluorophenyl)-2-methylpropanedioic acid bis(2-methylpropyl) ester IUPAC Name: bis(2-methylpropyl) 2-(4-amino-3-fluorophenyl)-2-methylpropanedioate Traditional Name: 2-(4-amino-3-fluoro-phenyl)-2-methyl-malonic acid diisobutyl ester Formula: C18H26FNO4 MolecularWeight: 339.401743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(C)(C1=CC(=C(C=C1)N)F)C(=O)OCC(C)C

Isomeric SMILES

CC(C)COC(=O)C(C)(C1=CC(=C(C=C1)N)F)C(=O)OCC(C)C

InChI

InChI=1S/C18H26FNO4/c1-11(2)9-23-16(21)18(5,17(22)24-10-12(3)4)13-6-7-15(20)14(19)8-13/h6-8,11-12H,9-10,20H2,1-5H3