methyl 2,4-bis(fluoranyl)-5-(3-phenylbutanoylamino)benzoate

Systemtic Name: methyl 2,4-bis(fluoranyl)-5-(3-phenylbutanoylamino)benzoate Openeye Name: methyl 2,4-difluoro-5-(3-phenylbutanoylamino)benzoate CAS Name: 2,4-difluoro-5-[(1-oxo-3-phenylbutyl)amino]benzoic acid methyl ester IUPAC Name: methyl 2,4-difluoro-5-(3-phenylbutanoylamino)benzoate Traditional Name: 2,4-difluoro-5-(3-phenylbutanoylamino)benzoic acid methyl ester Formula: C18H17F2NO3 MolecularWeight: 333.329286

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=C(C=C(C(=C1)C(=O)OC)F)F)C2=CC=CC=C2

Isomeric SMILES

CC(CC(=O)NC1=C(C=C(C(=C1)C(=O)OC)F)F)C2=CC=CC=C2

InChI

InChI=1S/C18H17F2NO3/c1-11(12-6-4-3-5-7-12)8-17(22)21-16-9-13(18(23)24-2)14(19)10-15(16)20/h3-7,9-11H,8H2,1-2H3,(H,21,22)