3-bromanyl-5-ethoxy-4-pentoxy-benzoic acid

Systemtic Name: 3-bromanyl-5-ethoxy-4-pentoxy-benzoic acid Openeye Name: 3-bromo-5-ethoxy-4-pentoxy-benzoic acid CAS Name: 3-bromo-5-ethoxy-4-pentoxybenzoic acid IUPAC Name: 3-bromo-5-ethoxy-4-pentoxybenzoic acid Traditional Name: 4-amoxy-3-bromo-5-ethoxy-benzoic acid Formula: C14H19BrO4 MolecularWeight: 331.20226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1Br)C(=O)O)OCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1Br)C(=O)O)OCC

InChI

InChI=1S/C14H19BrO4/c1-3-5-6-7-19-13-11(15)8-10(14(16)17)9-12(13)18-4-2/h8-9H,3-7H2,1-2H3,(H,16,17)