2-[[2-(4-chlorophenyl)-3-methyl-butanoyl]amino]ethanoic acid

Systemtic Name: 2-[[2-(4-chlorophenyl)-3-methyl-butanoyl]amino]ethanoic acid Openeye Name: 2-[[2-(4-chlorophenyl)-3-methyl-butanoyl]amino]acetic acid CAS Name: 2-[[2-(4-chlorophenyl)-3-methyl-1-oxobutyl]amino]acetic acid IUPAC Name: 2-[[2-(4-chlorophenyl)-3-methylbutanoyl]amino]acetic acid Traditional Name: 2-[[2-(4-chlorophenyl)-3-methyl-butanoyl]amino]acetic acid Formula: C13H16ClNO3 MolecularWeight: 269.72404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)NCC(=O)O

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)NCC(=O)O

InChI

InChI=1S/C13H16ClNO3/c1-8(2)12(13(18)15-7-11(16)17)9-3-5-10(14)6-4-9/h3-6,8,12H,7H2,1-2H3,(H,15,18)(H,16,17)