2-[(3-bromophenyl)sulfonylamino]-4,5-dimethoxy-benzoic acid

Systemtic Name: 2-[(3-bromophenyl)sulfonylamino]-4,5-dimethoxy-benzoic acid Openeye Name: 2-[(3-bromophenyl)sulfonylamino]-4,5-dimethoxy-benzoic acid CAS Name: 2-[(3-bromophenyl)sulfonylamino]-4,5-dimethoxybenzoic acid IUPAC Name: 2-[(3-bromophenyl)sulfonylamino]-4,5-dimethoxybenzoic acid Traditional Name: 2-[(3-bromophenyl)sulfonylamino]-4,5-dimethoxy-benzoic acid Formula: C15H14BrNO6S MolecularWeight: 416.24376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC(=CC=C2)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC(=CC=C2)Br)OC

InChI

InChI=1S/C15H14BrNO6S/c1-22-13-7-11(15(18)19)12(8-14(13)23-2)17-24(20,21)10-5-3-4-9(16)6-10/h3-8,17H,1-2H3,(H,18,19)