(2-chloranyl-6-fluoranyl-phenyl)methyl 3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: 3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: 3-methyl-2-[(2-phenylacetyl)amino]butyric acid (2-chloro-6-fluoro-benzyl) ester Formula: C20H21ClFNO3 MolecularWeight: 377.837043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=C(C=CC=C1Cl)F)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)OCC1=C(C=CC=C1Cl)F)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C20H21ClFNO3/c1-13(2)19(23-18(24)11-14-7-4-3-5-8-14)20(25)26-12-15-16(21)9-6-10-17(15)22/h3-10,13,19H,11-12H2,1-2H3,(H,23,24)