N-[2,3-bis(bromanyl)-5-methyl-4-oxidanyl-phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[2,3-bis(bromanyl)-5-methyl-4-oxidanyl-phenyl]-3-nitro-benzenesulfonamide Openeye Name: N-(2,3-dibromo-4-hydroxy-5-methyl-phenyl)-3-nitro-benzenesulfonamide CAS Name: N-(2,3-dibromo-4-hydroxy-5-methylphenyl)-3-nitrobenzenesulfonamide IUPAC Name: N-(2,3-dibromo-4-hydroxy-5-methylphenyl)-3-nitrobenzenesulfonamide Traditional Name: N-(2,3-dibromo-4-hydroxy-5-methyl-phenyl)-3-nitro-benzenesulfonamide Formula: C13H10Br2N2O5S MolecularWeight: 466.1019

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1O)Br)Br)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1O)Br)Br)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H10Br2N2O5S/c1-7-5-10(11(14)12(15)13(7)18)16-23(21,22)9-4-2-3-8(6-9)17(19)20/h2-6,16,18H,1H3