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

Systemtic Name: [(2S)-1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl] 2-azanyl-4-fluoranyl-benzoate Openeye Name: [(1S)-1-methyl-2-(2-naphthylamino)-2-oxo-ethyl] 2-amino-4-fluoro-benzoate CAS Name: 2-amino-4-fluorobenzoic acid [(2S)-1-(2-naphthalenylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(naphthalen-2-ylamino)-1-oxopropan-2-yl] 2-amino-4-fluorobenzoate Traditional Name: 2-amino-4-fluoro-benzoic acid [(1S)-2-keto-1-methyl-2-(2-naphthylamino)ethyl] ester Formula: C20H17FN2O3 MolecularWeight: 352.358983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)C3=C(C=C(C=C3)F)N

Isomeric SMILES

C[C@@H](C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)C3=C(C=C(C=C3)F)N

InChI

InChI=1S/C20H17FN2O3/c1-12(26-20(25)17-9-7-15(21)11-18(17)22)19(24)23-16-8-6-13-4-2-3-5-14(13)10-16/h2-12H,22H2,1H3,(H,23,24)/t12-/m0/s1