dimethyl (3R)-1-[(2,4-dimethoxyphenyl)methyl]-4-oxidanylidene-3-[3-[2,2,2-tris(fluoranyl)ethanoylamino]propyl]azetidine-2,2-dicarboxylate

Systemtic Name: dimethyl (3R)-1-[(2,4-dimethoxyphenyl)methyl]-4-oxidanylidene-3-[3-[2,2,2-tris(fluoranyl)ethanoylamino]propyl]azetidine-2,2-dicarboxylate Openeye Name: dimethyl (3R)-1-[(2,4-dimethoxyphenyl)methyl]-4-oxo-3-[3-[(2,2,2-trifluoroacetyl)amino]propyl]azetidine-2,2-dicarboxylate CAS Name: (3R)-1-[(2,4-dimethoxyphenyl)methyl]-4-oxo-3-[3-[(2,2,2-trifluoro-1-oxoethyl)amino]propyl]azetidine-2,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (3R)-1-[(2,4-dimethoxyphenyl)methyl]-4-oxo-3-[3-[(2,2,2-trifluoroacetyl)amino]propyl]azetidine-2,2-dicarboxylate Traditional Name: (3R)-1-(2,4-dimethoxybenzyl)-4-keto-3-[3-[(2,2,2-trifluoroacetyl)amino]propyl]azetidine-2,2-dicarboxylic acid dimethyl ester Formula: C21H25F3N2O8 MolecularWeight: 490.42701

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2C(=O)C(C2(C(=O)OC)C(=O)OC)CCCNC(=O)C(F)(F)F)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN2C(=O)[C@@H](C2(C(=O)OC)C(=O)OC)CCCNC(=O)C(F)(F)F)OC

InChI

InChI=1S/C21H25F3N2O8/c1-31-13-8-7-12(15(10-13)32-2)11-26-16(27)14(6-5-9-25-17(28)21(22,23)24)20(26,18(29)33-3)19(30)34-4/h7-8,10,14H,5-6,9,11H2,1-4H3,(H,25,28)/t14-/m0/s1