3-[[2,5-bis(bromanyl)phenyl]sulfonylamino]-4-methyl-benzoic acid

Systemtic Name: 3-[[2,5-bis(bromanyl)phenyl]sulfonylamino]-4-methyl-benzoic acid Openeye Name: 3-[(2,5-dibromophenyl)sulfonylamino]-4-methyl-benzoic acid CAS Name: 3-[(2,5-dibromophenyl)sulfonylamino]-4-methylbenzoic acid IUPAC Name: 3-[(2,5-dibromophenyl)sulfonylamino]-4-methylbenzoic acid Traditional Name: 3-[(2,5-dibromophenyl)sulfonylamino]-4-methyl-benzoic acid Formula: C14H11Br2NO4S MolecularWeight: 449.11444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NS(=O)(=O)C2=C(C=CC(=C2)Br)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NS(=O)(=O)C2=C(C=CC(=C2)Br)Br

InChI

InChI=1S/C14H11Br2NO4S/c1-8-2-3-9(14(18)19)6-12(8)17-22(20,21)13-7-10(15)4-5-11(13)16/h2-7,17H,1H3,(H,18,19)