2-[(4-bromophenyl)sulfonyl-(2,3-dihydro-1,4-benzodioxin-6-yl)amino]ethanoic acid

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-(2,3-dihydro-1,4-benzodioxin-6-yl)amino]ethanoic acid Openeye Name: 2-[(4-bromophenyl)sulfonyl-(2,3-dihydro-1,4-benzodioxin-6-yl)amino]acetic acid CAS Name: 2-[(4-bromophenyl)sulfonyl-(2,3-dihydro-1,4-benzodioxin-6-yl)amino]acetic acid IUPAC Name: 2-[(4-bromophenyl)sulfonyl-(2,3-dihydro-1,4-benzodioxin-6-yl)amino]acetic acid Traditional Name: 2-[brosyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]acetic acid Formula: C16H14BrNO6S MolecularWeight: 428.25446

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N(CC(=O)O)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N(CC(=O)O)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H14BrNO6S/c17-11-1-4-13(5-2-11)25(21,22)18(10-16(19)20)12-3-6-14-15(9-12)24-8-7-23-14/h1-6,9H,7-8,10H2,(H,19,20)