5-bromanyl-3-methoxy-2-propoxy-benzoic acid

Systemtic Name: 5-bromanyl-3-methoxy-2-propoxy-benzoic acid Openeye Name: 5-bromo-3-methoxy-2-propoxy-benzoic acid CAS Name: 5-bromo-3-methoxy-2-propoxybenzoic acid IUPAC Name: 5-bromo-3-methoxy-2-propoxybenzoic acid Traditional Name: 5-bromo-3-methoxy-2-propoxy-benzoic acid Formula: C11H13BrO4 MolecularWeight: 289.12252

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1C(=O)O)Br)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1C(=O)O)Br)OC

InChI

InChI=1S/C11H13BrO4/c1-3-4-16-10-8(11(13)14)5-7(12)6-9(10)15-2/h5-6H,3-4H2,1-2H3,(H,13,14)