2-[(3-bromophenyl)carbonylamino]hexanoic acid

Systemtic Name: 2-[(3-bromophenyl)carbonylamino]hexanoic acid Openeye Name: 2-[(3-bromobenzoyl)amino]hexanoic acid CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 2-[(3-bromobenzoyl)amino]hexanoic acid Traditional Name: 2-[(3-bromobenzoyl)amino]hexanoic acid Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C1=CC(=CC=C1)Br

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)C1=CC(=CC=C1)Br

InChI

InChI=1S/C13H16BrNO3/c1-2-3-7-11(13(17)18)15-12(16)9-5-4-6-10(14)8-9/h4-6,8,11H,2-3,7H2,1H3,(H,15,16)(H,17,18)