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

Systemtic Name: (2-methylphenyl) 2-[(4-bromophenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: o-tolyl 2-[(4-bromophenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-bromophenyl)sulfonyl-methylamino]acetic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 2-[(4-bromophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[brosyl(methyl)amino]acetic acid o-tolyl ester Formula: C16H16BrNO4S MolecularWeight: 398.27154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC=CC=C1OC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H16BrNO4S/c1-12-5-3-4-6-15(12)22-16(19)11-18(2)23(20,21)14-9-7-13(17)8-10-14/h3-10H,11H2,1-2H3