4-[4-(8-bromanyloctoxy)phenyl]benzoic acid

Systemtic Name: 4-[4-(8-bromanyloctoxy)phenyl]benzoic acid Openeye Name: 4-[4-(8-bromooctoxy)phenyl]benzoic acid CAS Name: 4-[4-(8-bromooctoxy)phenyl]benzoic acid IUPAC Name: 4-[4-(8-bromooctoxy)phenyl]benzoic acid Traditional Name: 4-[4-(8-bromooctoxy)phenyl]benzoic acid Formula: C21H25BrO3 MolecularWeight: 405.3254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)OCCCCCCCCBr)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)OCCCCCCCCBr)C(=O)O

InChI

InChI=1S/C21H25BrO3/c22-15-5-3-1-2-4-6-16-25-20-13-11-18(12-14-20)17-7-9-19(10-8-17)21(23)24/h7-14H,1-6,15-16H2,(H,23,24)