(2S)-2-[(3-chlorophenyl)methyl-ethanoyl-amino]propanoate

Systemtic Name: (2S)-2-[(3-chlorophenyl)methyl-ethanoyl-amino]propanoate Openeye Name: (2S)-2-[acetyl-[(3-chlorophenyl)methyl]amino]propanoate CAS Name: (2S)-2-[acetyl-[(3-chlorophenyl)methyl]amino]propanoate IUPAC Name: (2S)-2-[acetyl-[(3-chlorophenyl)methyl]amino]propanoate Traditional Name: (2S)-2-[acetyl-(3-chlorobenzyl)amino]propionate Formula: C12H13ClNO3- MolecularWeight: 254.68952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N(CC1=CC(=CC=C1)Cl)C(=O)C

Isomeric SMILES

C[C@@H](C(=O)[O-])N(CC1=CC(=CC=C1)Cl)C(=O)C

InChI

InChI=1S/C12H14ClNO3/c1-8(12(16)17)14(9(2)15)7-10-4-3-5-11(13)6-10/h3-6,8H,7H2,1-2H3,(H,16,17)/p-1/t8-/m0/s1