[(2S)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranylpyridine-4-carboxylate

Systemtic Name: [(2S)-1-[(4-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranylpyridine-4-carboxylate Openeye Name: [(1S)-2-(4-fluoroanilino)-1-methyl-2-oxo-ethyl] 2-chloropyridine-4-carboxylate CAS Name: 2-chloro-4-pyridinecarboxylic acid [(2S)-1-(4-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-fluoroanilino)-1-oxopropan-2-yl] 2-chloropyridine-4-carboxylate Traditional Name: 2-chloroisonicotinic acid [(1S)-2-(4-fluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C15H12ClFN2O3 MolecularWeight: 322.718783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)F)OC(=O)C2=CC(=NC=C2)Cl

InChI

InChI=1S/C15H12ClFN2O3/c1-9(14(20)19-12-4-2-11(17)3-5-12)22-15(21)10-6-7-18-13(16)8-10/h2-9H,1H3,(H,19,20)/t9-/m0/s1