dipropan-2-yl 2-[2-azanyl-4-(trifluoromethyl)phenyl]propanedioate

Systemtic Name: dipropan-2-yl 2-[2-azanyl-4-(trifluoromethyl)phenyl]propanedioate Openeye Name: diisopropyl 2-[2-amino-4-(trifluoromethyl)phenyl]propanedioate CAS Name: 2-[2-amino-4-(trifluoromethyl)phenyl]propanedioic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 2-[2-amino-4-(trifluoromethyl)phenyl]propanedioate Traditional Name: 2-[2-amino-4-(trifluoromethyl)phenyl]malonic acid diisopropyl ester Formula: C16H20F3NO4 MolecularWeight: 347.32951

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C1=C(C=C(C=C1)C(F)(F)F)N)C(=O)OC(C)C

Isomeric SMILES

CC(C)OC(=O)C(C1=C(C=C(C=C1)C(F)(F)F)N)C(=O)OC(C)C

InChI

InChI=1S/C16H20F3NO4/c1-8(2)23-14(21)13(15(22)24-9(3)4)11-6-5-10(7-12(11)20)16(17,18)19/h5-9,13H,20H2,1-4H3