[(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3,4-bis(fluoranyl)benzoate

Systemtic Name: [(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3,4-bis(fluoranyl)benzoate Openeye Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 3,4-difluorobenzoate CAS Name: 3,4-difluorobenzoic acid [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] 3,4-difluorobenzoate Traditional Name: 3,4-difluorobenzoic acid [(1R)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C18H15F2NO3 MolecularWeight: 331.313406

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC(=C(C=C3)F)F

Isomeric SMILES

C1CC1NC(=O)[C@@H](C2=CC=CC=C2)OC(=O)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C18H15F2NO3/c19-14-9-6-12(10-15(14)20)18(23)24-16(11-4-2-1-3-5-11)17(22)21-13-7-8-13/h1-6,9-10,13,16H,7-8H2,(H,21,22)/t16-/m1/s1