[(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-chloranyl-2-fluoranyl-benzoate

Systemtic Name: [(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-chloranyl-2-fluoranyl-benzoate Openeye Name: [(1S)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 4-chloro-2-fluoro-benzoate CAS Name: 4-chloro-2-fluorobenzoic acid [(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] 4-chloro-2-fluorobenzoate Traditional Name: 4-chloro-2-fluoro-benzoic acid [(1S)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C18H15ClFNO3 MolecularWeight: 347.768003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClFNO3/c19-12-6-9-14(15(20)10-12)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-/m0/s1