6-[2-(4-bromophenyl)pyridin-3-yl]hexanoic acid

Systemtic Name: 6-[2-(4-bromophenyl)pyridin-3-yl]hexanoic acid Openeye Name: 6-[2-(4-bromophenyl)-3-pyridyl]hexanoic acid CAS Name: 6-[2-(4-bromophenyl)-3-pyridinyl]hexanoic acid IUPAC Name: 6-[2-(4-bromophenyl)pyridin-3-yl]hexanoic acid Traditional Name: 6-[2-(4-bromophenyl)-3-pyridyl]hexanoic acid Formula: C17H18BrNO2 MolecularWeight: 348.23432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)C2=CC=C(C=C2)Br)CCCCCC(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)C2=CC=C(C=C2)Br)CCCCCC(=O)O

InChI

InChI=1S/C17H18BrNO2/c18-15-10-8-14(9-11-15)17-13(6-4-12-19-17)5-2-1-3-7-16(20)21/h4,6,8-12H,1-3,5,7H2,(H,20,21)