2-[(3-bromophenyl)-(phenylsulfonyl)amino]ethanoate

Systemtic Name: 2-[(3-bromophenyl)-(phenylsulfonyl)amino]ethanoate Openeye Name: 2-[N-(benzenesulfonyl)-3-bromo-anilino]acetate CAS Name: 2-[N-(benzenesulfonyl)-3-bromoanilino]acetate IUPAC Name: 2-[N-(benzenesulfonyl)-3-bromoanilino]acetate Traditional Name: 2-(N-besyl-3-bromo-anilino)acetate Formula: C14H11BrNO4S- MolecularWeight: 369.21044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CC(=O)[O-])C2=CC(=CC=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CC(=O)[O-])C2=CC(=CC=C2)Br

InChI

InChI=1S/C14H12BrNO4S/c15-11-5-4-6-12(9-11)16(10-14(17)18)21(19,20)13-7-2-1-3-8-13/h1-9H,10H2,(H,17,18)/p-1