2-[2,2-bis(bromanyl)propoxycarbonyl-phenyl-amino]ethanoic acid

Systemtic Name: 2-[2,2-bis(bromanyl)propoxycarbonyl-phenyl-amino]ethanoic acid Openeye Name: 2-[N-(2,2-dibromopropoxycarbonyl)anilino]acetic acid CAS Name: 2-(N-[2,2-dibromopropoxy(oxo)methyl]anilino)acetic acid IUPAC Name: 2-[N-(2,2-dibromopropoxycarbonyl)anilino]acetic acid Traditional Name: 2-[N-(2,2-dibromopropoxycarbonyl)anilino]acetic acid Formula: C12H13Br2NO4 MolecularWeight: 395.04392

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)N(CC(=O)O)C1=CC=CC=C1)(Br)Br

Isomeric SMILES

CC(COC(=O)N(CC(=O)O)C1=CC=CC=C1)(Br)Br

InChI

InChI=1S/C12H13Br2NO4/c1-12(13,14)8-19-11(18)15(7-10(16)17)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,16,17)