2-(3-bromanyl-4-hexoxy-5-methoxy-phenyl)ethanoic acid

Systemtic Name: 2-(3-bromanyl-4-hexoxy-5-methoxy-phenyl)ethanoic acid Openeye Name: 2-(3-bromo-4-hexoxy-5-methoxy-phenyl)acetic acid CAS Name: 2-(3-bromo-4-hexoxy-5-methoxyphenyl)acetic acid IUPAC Name: 2-(3-bromo-4-hexoxy-5-methoxyphenyl)acetic acid Traditional Name: 2-(3-bromo-4-hexoxy-5-methoxy-phenyl)acetic acid Formula: C15H21BrO4 MolecularWeight: 345.22884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1Br)CC(=O)O)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1Br)CC(=O)O)OC

InChI

InChI=1S/C15H21BrO4/c1-3-4-5-6-7-20-15-12(16)8-11(10-14(17)18)9-13(15)19-2/h8-9H,3-7,10H2,1-2H3,(H,17,18)