3-pyridin-4-ylpropyl (2S)-2-oxidanyl-3-phenyl-propanoate

Systemtic Name: 3-pyridin-4-ylpropyl (2S)-2-oxidanyl-3-phenyl-propanoate Openeye Name: 3-(4-pyridyl)propyl (2S)-2-hydroxy-3-phenyl-propanoate CAS Name: (2S)-2-hydroxy-3-phenylpropanoic acid 3-pyridin-4-ylpropyl ester IUPAC Name: 3-pyridin-4-ylpropyl (2S)-2-hydroxy-3-phenylpropanoate Traditional Name: (2S)-2-hydroxy-3-phenyl-propionic acid 3-(4-pyridyl)propyl ester Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCCCC2=CC=NC=C2)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)OCCCC2=CC=NC=C2)O

InChI

InChI=1S/C17H19NO3/c19-16(13-15-5-2-1-3-6-15)17(20)21-12-4-7-14-8-10-18-11-9-14/h1-3,5-6,8-11,16,19H,4,7,12-13H2/t16-/m0/s1