(2S)-6-azanyl-2-(phenylcarbonyloxymethylamino)hexanoic acid

Systemtic Name: (2S)-6-azanyl-2-(phenylcarbonyloxymethylamino)hexanoic acid Openeye Name: (2S)-6-amino-2-(benzoyloxymethylamino)hexanoic acid CAS Name: (2S)-6-amino-2-(benzoyloxymethylamino)hexanoic acid IUPAC Name: (2S)-6-amino-2-(benzoyloxymethylamino)hexanoic acid Traditional Name: (2S)-6-amino-2-(benzoyloxymethylamino)hexanoic acid Formula: C14H20N2O4 MolecularWeight: 280.3196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCNC(CCCCN)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCN[C@@H](CCCCN)C(=O)O

InChI

InChI=1S/C14H20N2O4/c15-9-5-4-8-12(13(17)18)16-10-20-14(19)11-6-2-1-3-7-11/h1-3,6-7,12,16H,4-5,8-10,15H2,(H,17,18)/t12-/m0/s1