8-[(2-bromophenyl)carbonylamino]octanoic acid

Systemtic Name: 8-[(2-bromophenyl)carbonylamino]octanoic acid Openeye Name: 8-[(2-bromobenzoyl)amino]octanoic acid CAS Name: 8-[[(2-bromophenyl)-oxomethyl]amino]octanoic acid IUPAC Name: 8-[(2-bromobenzoyl)amino]octanoic acid Traditional Name: 8-[(2-bromobenzoyl)amino]caprylic acid Formula: C15H20BrNO3 MolecularWeight: 342.2282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCCCCCCC(=O)O)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCCCCCCC(=O)O)Br

InChI

InChI=1S/C15H20BrNO3/c16-13-9-6-5-8-12(13)15(20)17-11-7-3-1-2-4-10-14(18)19/h5-6,8-9H,1-4,7,10-11H2,(H,17,20)(H,18,19)