[(2S)-1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] 4-chloranyl-2-fluoranyl-benzoate

Systemtic Name: [(2S)-1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] 4-chloranyl-2-fluoranyl-benzoate Openeye Name: [(1S)-1-methyl-2-(1-naphthylamino)-2-oxo-ethyl] 4-chloro-2-fluoro-benzoate CAS Name: 4-chloro-2-fluorobenzoic acid [(2S)-1-(1-naphthalenylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(naphthalen-1-ylamino)-1-oxopropan-2-yl] 4-chloro-2-fluorobenzoate Traditional Name: 4-chloro-2-fluoro-benzoic acid [(1S)-2-keto-1-methyl-2-(1-naphthylamino)ethyl] ester Formula: C20H15ClFNO3 MolecularWeight: 371.789403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)C3=C(C=C(C=C3)Cl)F

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)C3=C(C=C(C=C3)Cl)F

InChI

InChI=1S/C20H15ClFNO3/c1-12(26-20(25)16-10-9-14(21)11-17(16)22)19(24)23-18-8-4-6-13-5-2-3-7-15(13)18/h2-12H,1H3,(H,23,24)/t12-/m0/s1