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

Systemtic Name: 3-bromanyl-5-ethoxy-4-heptoxy-benzoic acid Openeye Name: 3-bromo-5-ethoxy-4-heptoxy-benzoic acid CAS Name: 3-bromo-5-ethoxy-4-heptoxybenzoic acid IUPAC Name: 3-bromo-5-ethoxy-4-heptoxybenzoic acid Traditional Name: 3-bromo-5-ethoxy-4-heptoxy-benzoic acid Formula: C16H23BrO4 MolecularWeight: 359.25542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C(C=C1Br)C(=O)O)OCC

Isomeric SMILES

CCCCCCCOC1=C(C=C(C=C1Br)C(=O)O)OCC

InChI

InChI=1S/C16H23BrO4/c1-3-5-6-7-8-9-21-15-13(17)10-12(16(18)19)11-14(15)20-4-2/h10-11H,3-9H2,1-2H3,(H,18,19)