5-[4-(5-bromanylpentoxy)-3-(3-ethoxy-3-oxidanylidene-propyl)phenyl]pentanoic acid

Systemtic Name: 5-[4-(5-bromanylpentoxy)-3-(3-ethoxy-3-oxidanylidene-propyl)phenyl]pentanoic acid Openeye Name: 5-[4-(5-bromopentoxy)-3-(3-ethoxy-3-oxo-propyl)phenyl]pentanoic acid CAS Name: 5-[4-(5-bromopentoxy)-3-(3-ethoxy-3-oxopropyl)phenyl]pentanoic acid IUPAC Name: 5-[4-(5-bromopentoxy)-3-(3-ethoxy-3-oxopropyl)phenyl]pentanoic acid Traditional Name: 5-[4-(5-bromopentoxy)-3-(3-ethoxy-3-keto-propyl)phenyl]valeric acid Formula: C21H31BrO5 MolecularWeight: 443.37184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C=CC(=C1)CCCCC(=O)O)OCCCCCBr

Isomeric SMILES

CCOC(=O)CCC1=C(C=CC(=C1)CCCCC(=O)O)OCCCCCBr

InChI

InChI=1S/C21H31BrO5/c1-2-26-21(25)13-11-18-16-17(8-4-5-9-20(23)24)10-12-19(18)27-15-7-3-6-14-22/h10,12,16H,2-9,11,13-15H2,1H3,(H,23,24)