[(2S)-1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 6-acetamidopyridine-2-carboxylate

Systemtic Name: [(2S)-1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 6-acetamidopyridine-2-carboxylate Openeye Name: [(1S)-2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl] 6-acetamidopyridine-2-carboxylate CAS Name: 6-acetamido-2-pyridinecarboxylic acid [(2S)-1-(4-ethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-ethylphenyl)-1-oxopropan-2-yl] 6-acetamidopyridine-2-carboxylate Traditional Name: 6-acetamidopicolinic acid [(1S)-2-(4-ethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=NC(=CC=C2)NC(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)C2=NC(=CC=C2)NC(=O)C

InChI

InChI=1S/C19H20N2O4/c1-4-14-8-10-15(11-9-14)18(23)12(2)25-19(24)16-6-5-7-17(21-16)20-13(3)22/h5-12H,4H2,1-3H3,(H,20,21,22)/t12-/m0/s1