2-azanyl-5-[2,3-bis(bromanyl)propanoylamino]-4-methoxy-benzenesulfonic acid

Systemtic Name: 2-azanyl-5-[2,3-bis(bromanyl)propanoylamino]-4-methoxy-benzenesulfonic acid Openeye Name: 2-amino-5-(2,3-dibromopropanoylamino)-4-methoxy-benzenesulfonic acid CAS Name: 2-amino-5-[(2,3-dibromo-1-oxopropyl)amino]-4-methoxybenzenesulfonic acid IUPAC Name: 2-amino-5-(2,3-dibromopropanoylamino)-4-methoxybenzenesulfonic acid Traditional Name: 2-amino-5-(2,3-dibromopropanoylamino)-4-methoxy-besylic acid Formula: C10H12Br2N2O5S MolecularWeight: 432.08568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)N)S(=O)(=O)O)NC(=O)C(CBr)Br

Isomeric SMILES

COC1=C(C=C(C(=C1)N)S(=O)(=O)O)NC(=O)C(CBr)Br

InChI

InChI=1S/C10H12Br2N2O5S/c1-19-8-2-6(13)9(20(16,17)18)3-7(8)14-10(15)5(12)4-11/h2-3,5H,4,13H2,1H3,(H,14,15)(H,16,17,18)