5-[(4-bromanyl-3-fluoranyl-phenoxy)methyl]-2-(cyclopropylcarbonylamino)benzoic acid

Systemtic Name: 5-[(4-bromanyl-3-fluoranyl-phenoxy)methyl]-2-(cyclopropylcarbonylamino)benzoic acid Openeye Name: 5-[(4-bromo-3-fluoro-phenoxy)methyl]-2-(cyclopropanecarbonylamino)benzoic acid CAS Name: 5-[(4-bromo-3-fluorophenoxy)methyl]-2-[[cyclopropyl(oxo)methyl]amino]benzoic acid IUPAC Name: 5-[(4-bromo-3-fluorophenoxy)methyl]-2-(cyclopropanecarbonylamino)benzoic acid Traditional Name: 5-[(4-bromo-3-fluoro-phenoxy)methyl]-2-(cyclopropanecarbonylamino)benzoic acid Formula: C18H15BrFNO4 MolecularWeight: 408.218403

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=C(C=C(C=C2)COC3=CC(=C(C=C3)Br)F)C(=O)O

Isomeric SMILES

C1CC1C(=O)NC2=C(C=C(C=C2)COC3=CC(=C(C=C3)Br)F)C(=O)O

InChI

InChI=1S/C18H15BrFNO4/c19-14-5-4-12(8-15(14)20)25-9-10-1-6-16(13(7-10)18(23)24)21-17(22)11-2-3-11/h1,4-8,11H,2-3,9H2,(H,21,22)(H,23,24)