2-[2-(2-chloranyl-4-methyl-phenyl)ethanoylamino]propanoic acid

Systemtic Name: 2-[2-(2-chloranyl-4-methyl-phenyl)ethanoylamino]propanoic acid Openeye Name: 2-[[2-(2-chloro-4-methyl-phenyl)acetyl]amino]propanoic acid CAS Name: 2-[[2-(2-chloro-4-methylphenyl)-1-oxoethyl]amino]propanoic acid IUPAC Name: 2-[[2-(2-chloro-4-methylphenyl)acetyl]amino]propanoic acid Traditional Name: 2-[[2-(2-chloro-4-methyl-phenyl)acetyl]amino]propionic acid Formula: C12H14ClNO3 MolecularWeight: 255.69746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CC(=O)NC(C)C(=O)O)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)CC(=O)NC(C)C(=O)O)Cl

InChI

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