2-bromanyl-3-(4-fluoranyl-3-methoxycarbonyl-phenyl)propanoic acid

Systemtic Name: 2-bromanyl-3-(4-fluoranyl-3-methoxycarbonyl-phenyl)propanoic acid Openeye Name: 2-bromo-3-(4-fluoro-3-methoxycarbonyl-phenyl)propanoic acid CAS Name: 2-bromo-3-(4-fluoro-3-methoxycarbonylphenyl)propanoic acid IUPAC Name: 2-bromo-3-(4-fluoro-3-methoxycarbonylphenyl)propanoic acid Traditional Name: 2-bromo-3-(3-carbomethoxy-4-fluoro-phenyl)propionic acid Formula: C11H10BrFO4 MolecularWeight: 305.097103

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)CC(C(=O)O)Br)F

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)CC(C(=O)O)Br)F

InChI

InChI=1S/C11H10BrFO4/c1-17-11(16)7-4-6(2-3-9(7)13)5-8(12)10(14)15/h2-4,8H,5H2,1H3,(H,14,15)