methyl 2-[[[5-bromanyl-2-(phenylsulfonylamino)phenyl]-phenyl-methyl]amino]ethanoate

Systemtic Name: methyl 2-[[[5-bromanyl-2-(phenylsulfonylamino)phenyl]-phenyl-methyl]amino]ethanoate Openeye Name: methyl 2-[[[2-(benzenesulfonamido)-5-bromo-phenyl]-phenyl-methyl]amino]acetate CAS Name: 2-[[[2-(benzenesulfonamido)-5-bromophenyl]-phenylmethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[[2-(benzenesulfonamido)-5-bromophenyl]-phenylmethyl]amino]acetate Traditional Name: 2-[[[2-(benzenesulfonamido)-5-bromo-phenyl]-phenyl-methyl]amino]acetic acid methyl ester Formula: C22H21BrN2O4S MolecularWeight: 489.38214

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(C1=CC=CC=C1)C2=C(C=CC(=C2)Br)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CNC(C1=CC=CC=C1)C2=C(C=CC(=C2)Br)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21BrN2O4S/c1-29-21(26)15-24-22(16-8-4-2-5-9-16)19-14-17(23)12-13-20(19)25-30(27,28)18-10-6-3-7-11-18/h2-14,22,24-25H,15H2,1H3