2-[(3-bromophenyl)-(4-methylphenyl)sulfonyl-amino]ethanoate

Systemtic Name: 2-[(3-bromophenyl)-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: 2-[3-bromo-N-(p-tolylsulfonyl)anilino]acetate CAS Name: 2-(3-bromo-N-(4-methylphenyl)sulfonylanilino)acetate IUPAC Name: 2-(3-bromo-N-(4-methylphenyl)sulfonylanilino)acetate Traditional Name: 2-(3-bromo-N-tosyl-anilino)acetate Formula: C15H13BrNO4S- MolecularWeight: 383.23702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)[O-])C2=CC(=CC=C2)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)[O-])C2=CC(=CC=C2)Br

InChI

InChI=1S/C15H14BrNO4S/c1-11-5-7-14(8-6-11)22(20,21)17(10-15(18)19)13-4-2-3-12(16)9-13/h2-9H,10H2,1H3,(H,18,19)/p-1