2-[(2-bromanyl-5-methoxy-phenyl)methyl]butanoic acid

Systemtic Name: 2-[(2-bromanyl-5-methoxy-phenyl)methyl]butanoic acid Openeye Name: 2-[(2-bromo-5-methoxy-phenyl)methyl]butanoic acid CAS Name: 2-[(2-bromo-5-methoxyphenyl)methyl]butanoic acid IUPAC Name: 2-[(2-bromo-5-methoxyphenyl)methyl]butanoic acid Traditional Name: 2-(2-bromo-5-methoxy-benzyl)butyric acid Formula: C12H15BrO3 MolecularWeight: 287.1497

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=C(C=CC(=C1)OC)Br)C(=O)O

Isomeric SMILES

CCC(CC1=C(C=CC(=C1)OC)Br)C(=O)O

InChI

InChI=1S/C12H15BrO3/c1-3-8(12(14)15)6-9-7-10(16-2)4-5-11(9)13/h4-5,7-8H,3,6H2,1-2H3,(H,14,15)