[(2S)-6-oxidanylidene-2,3-dihydro-1H-pyridin-2-yl]methyl benzoate

Systemtic Name: [(2S)-6-oxidanylidene-2,3-dihydro-1H-pyridin-2-yl]methyl benzoate Openeye Name: [(2S)-6-oxo-2,3-dihydro-1H-pyridin-2-yl]methyl benzoate CAS Name: benzoic acid [(2S)-6-oxo-2,3-dihydro-1H-pyridin-2-yl]methyl ester IUPAC Name: [(2S)-6-oxo-2,3-dihydro-1H-pyridin-2-yl]methyl benzoate Traditional Name: benzoic acid [(2S)-6-keto-2,3-dihydro-1H-pyridin-2-yl]methyl ester Formula: C13H13NO3 MolecularWeight: 231.24722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=O)NC1COC(=O)C2=CC=CC=C2

Isomeric SMILES

C1C=CC(=O)N[C@@H]1COC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H13NO3/c15-12-8-4-7-11(14-12)9-17-13(16)10-5-2-1-3-6-10/h1-6,8,11H,7,9H2,(H,14,15)/t11-/m0/s1