3-[butanoyl-(2-chlorophenyl)amino]propanoic acid

Systemtic Name: 3-[butanoyl-(2-chlorophenyl)amino]propanoic acid Openeye Name: 3-(N-butanoyl-2-chloro-anilino)propanoic acid CAS Name: 3-[2-chloro-N-(1-oxobutyl)anilino]propanoic acid IUPAC Name: 3-(N-butanoyl-2-chloroanilino)propanoic acid Traditional Name: 3-(N-butyryl-2-chloro-anilino)propionic acid Formula: C13H16ClNO3 MolecularWeight: 269.72404

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(CCC(=O)O)C1=CC=CC=C1Cl

Isomeric SMILES

CCCC(=O)N(CCC(=O)O)C1=CC=CC=C1Cl

InChI

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