(1S,2S)-1-azanyl-2-[(2-phenylethanoylamino)methyl]cyclopropane-1-carboxylic acid

Systemtic Name: (1S,2S)-1-azanyl-2-[(2-phenylethanoylamino)methyl]cyclopropane-1-carboxylic acid Openeye Name: (1S,2S)-1-amino-2-[[(2-phenylacetyl)amino]methyl]cyclopropanecarboxylic acid CAS Name: (1S,2S)-1-amino-2-[[(1-oxo-2-phenylethyl)amino]methyl]-1-cyclopropanecarboxylic acid IUPAC Name: (1S,2S)-1-amino-2-[[(2-phenylacetyl)amino]methyl]cyclopropane-1-carboxylic acid Traditional Name: (1S,2S)-1-amino-2-[[(2-phenylacetyl)amino]methyl]cyclopropanecarboxylic acid Formula: C13H16N2O3 MolecularWeight: 248.27774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C1(C(=O)O)N)CNC(=O)CC2=CC=CC=C2

Isomeric SMILES

C1[C@H]([C@@]1(C(=O)O)N)CNC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C13H16N2O3/c14-13(12(17)18)7-10(13)8-15-11(16)6-9-4-2-1-3-5-9/h1-5,10H,6-8,14H2,(H,15,16)(H,17,18)/t10-,13-/m0/s1