2-(4-bromanyl-2-fluoranyl-phenyl)-2-(phenylmethoxycarbonylamino)ethanoic acid

Systemtic Name: 2-(4-bromanyl-2-fluoranyl-phenyl)-2-(phenylmethoxycarbonylamino)ethanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-2-(4-bromo-2-fluoro-phenyl)acetic acid CAS Name: 2-(4-bromo-2-fluorophenyl)-2-(phenylmethoxycarbonylamino)acetic acid IUPAC Name: 2-(4-bromo-2-fluorophenyl)-2-(phenylmethoxycarbonylamino)acetic acid Traditional Name: 2-(benzyloxycarbonylamino)-2-(4-bromo-2-fluoro-phenyl)acetic acid Formula: C16H13BrFNO4 MolecularWeight: 382.181123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrFNO4/c17-11-6-7-12(13(18)8-11)14(15(20)21)19-16(22)23-9-10-4-2-1-3-5-10/h1-8,14H,9H2,(H,19,22)(H,20,21)