2-[(3-methylphenyl)-propanoyl-amino]ethanoic acid

Systemtic Name: 2-[(3-methylphenyl)-propanoyl-amino]ethanoic acid Openeye Name: 2-(3-methyl-N-propanoyl-anilino)acetic acid CAS Name: 2-[3-methyl-N-(1-oxopropyl)anilino]acetic acid IUPAC Name: 2-(3-methyl-N-propanoylanilino)acetic acid Traditional Name: 2-(3-methyl-N-propionyl-anilino)acetic acid Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC(=O)O)C1=CC=CC(=C1)C

Isomeric SMILES

CCC(=O)N(CC(=O)O)C1=CC=CC(=C1)C

InChI

InChI=1S/C12H15NO3/c1-3-11(14)13(8-12(15)16)10-6-4-5-9(2)7-10/h4-7H,3,8H2,1-2H3,(H,15,16)