[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] pyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] pyridine-3-carboxylate Openeye Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-keto-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)COC(=O)C1=CN=CC=C1)C2=CC=CC=C2

Isomeric SMILES

C[C@H](CNC(=O)COC(=O)C1=CN=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C17H18N2O3/c1-13(14-6-3-2-4-7-14)10-19-16(20)12-22-17(21)15-8-5-9-18-11-15/h2-9,11,13H,10,12H2,1H3,(H,19,20)/t13-/m1/s1