2,3,4-tris(bromanyl)-6-(bromanylcarbamoyl)-5-dodecyl-benzoic acid

Systemtic Name: 2,3,4-tris(bromanyl)-6-(bromanylcarbamoyl)-5-dodecyl-benzoic acid Openeye Name: 2,3,4-tribromo-6-(bromocarbamoyl)-5-dodecyl-benzoic acid CAS Name: 2,3,4-tribromo-6-[(bromoamino)-oxomethyl]-5-dodecylbenzoic acid IUPAC Name: 2,3,4-tribromo-6-(bromocarbamoyl)-5-dodecylbenzoic acid Traditional Name: 2,3,4-tribromo-6-(bromocarbamoyl)-5-lauryl-benzoic acid Formula: C20H27Br4NO3 MolecularWeight: 649.04928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(C(=C(C(=C1C(=O)NBr)C(=O)O)Br)Br)Br

Isomeric SMILES

CCCCCCCCCCCCC1=C(C(=C(C(=C1C(=O)NBr)C(=O)O)Br)Br)Br

InChI

InChI=1S/C20H27Br4NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(19(26)25-24)15(20(27)28)17(22)18(23)16(13)21/h2-12H2,1H3,(H,25,26)(H,27,28)