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

Systemtic Name: 3-(4-bromanyl-2-fluoranyl-phenyl)-3-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-3-(4-bromo-2-fluoro-phenyl)propanoic acid CAS Name: 3-(4-bromo-2-fluorophenyl)-3-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-(4-bromo-2-fluorophenyl)-3-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 3-(benzyloxycarbonylamino)-3-(4-bromo-2-fluoro-phenyl)propionic acid Formula: C17H15BrFNO4 MolecularWeight: 396.207703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C17H15BrFNO4/c18-12-6-7-13(14(19)8-12)15(9-16(21)22)20-17(23)24-10-11-4-2-1-3-5-11/h1-8,15H,9-10H2,(H,20,23)(H,21,22)