2-[(4-bromophenyl)-ethanoyl-amino]butanoic acid

Systemtic Name: 2-[(4-bromophenyl)-ethanoyl-amino]butanoic acid Openeye Name: 2-(N-acetyl-4-bromo-anilino)butanoic acid CAS Name: 2-(N-acetyl-4-bromoanilino)butanoic acid IUPAC Name: 2-(N-acetyl-4-bromoanilino)butanoic acid Traditional Name: 2-(N-acetyl-4-bromo-anilino)butyric acid Formula: C12H14BrNO3 MolecularWeight: 300.14846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrNO3/c1-3-11(12(16)17)14(8(2)15)10-6-4-9(13)5-7-10/h4-7,11H,3H2,1-2H3,(H,16,17)