5-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)pentanoic acid

Systemtic Name: 5-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)pentanoic acid Openeye Name: 5-(3-bromo-4-hydroxy-5-methoxy-phenyl)pentanoic acid CAS Name: 5-(3-bromo-4-hydroxy-5-methoxyphenyl)pentanoic acid IUPAC Name: 5-(3-bromo-4-hydroxy-5-methoxyphenyl)pentanoic acid Traditional Name: 5-(3-bromo-4-hydroxy-5-methoxy-phenyl)valeric acid Formula: C12H15BrO4 MolecularWeight: 303.1491

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CCCCC(=O)O)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)CCCCC(=O)O)Br)O

InChI

InChI=1S/C12H15BrO4/c1-17-10-7-8(6-9(13)12(10)16)4-2-3-5-11(14)15/h6-7,16H,2-5H2,1H3,(H,14,15)