3-(3-acetamido-2-methyl-phenyl)butanoic acid

Systemtic Name: 3-(3-acetamido-2-methyl-phenyl)butanoic acid Openeye Name: 3-(3-acetamido-2-methyl-phenyl)butanoic acid CAS Name: 3-(3-acetamido-2-methylphenyl)butanoic acid IUPAC Name: 3-(3-acetamido-2-methylphenyl)butanoic acid Traditional Name: 3-(3-acetamido-2-methyl-phenyl)butyric acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C)C(C)CC(=O)O

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C)C(C)CC(=O)O

InChI

InChI=1S/C13H17NO3/c1-8(7-13(16)17)11-5-4-6-12(9(11)2)14-10(3)15/h4-6,8H,7H2,1-3H3,(H,14,15)(H,16,17)