[(2S)-1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl] pyridine-3-carboxylate

Systemtic Name: [(2S)-1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl] pyridine-3-carboxylate Openeye Name: [(1S)-2-(3-chlorophenyl)-1-methyl-2-oxo-ethyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [(2S)-1-(3-chlorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(3-chlorophenyl)-1-oxopropan-2-yl] pyridine-3-carboxylate Traditional Name: nicotinic acid [(1S)-2-(3-chlorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C15H12ClNO3 MolecularWeight: 289.71368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC(=CC=C1)Cl)OC(=O)C2=CN=CC=C2

Isomeric SMILES

C[C@@H](C(=O)C1=CC(=CC=C1)Cl)OC(=O)C2=CN=CC=C2

InChI

InChI=1S/C15H12ClNO3/c1-10(14(18)11-4-2-6-13(16)8-11)20-15(19)12-5-3-7-17-9-12/h2-10H,1H3/t10-/m0/s1