Molecule ID: 6933157

IUPAC Name: (2R)-2-[(2-chloroacetyl)amino]-3-phenylpropanoate

Description: The molecule is an N-acyl-D-alpha-amino acid anion that is the conjugate base of N-chloroacetyl-D-phenylalanine, arising from the deprotonation of the carboxy group; major species at pH 7.3.

SMILES: O=C(O)[C@@H](Cc1ccccc1)N=C([O-])CCl

SELFIES: [O][=C][Branch1][C][O][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Branch1][C][O-1][C][Cl]

InChI: InChI=1S/C11H12ClNO3/c12-7-10(14)13-9(11(15)16)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,13,14)(H,15,16)/p-1/t9-/m1/s1

Molecular Properties:
- Polar Surface Area: 69.2 Ų
- LogP: 1.9