[phenyl(pyridin-2-yl)methyl] 2-[(4-bromophenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: [phenyl(pyridin-2-yl)methyl] 2-[(4-bromophenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: [phenyl(2-pyridyl)methyl] 2-[(4-bromophenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-bromophenyl)sulfonyl-methylamino]acetic acid [phenyl(2-pyridinyl)methyl] ester IUPAC Name: [phenyl(pyridin-2-yl)methyl] 2-[(4-bromophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[brosyl(methyl)amino]acetic acid [phenyl(2-pyridyl)methyl] ester Formula: C21H19BrN2O4S MolecularWeight: 475.35556

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC(C1=CC=CC=C1)C2=CC=CC=N2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(CC(=O)OC(C1=CC=CC=C1)C2=CC=CC=N2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H19BrN2O4S/c1-24(29(26,27)18-12-10-17(22)11-13-18)15-20(25)28-21(16-7-3-2-4-8-16)19-9-5-6-14-23-19/h2-14,21H,15H2,1H3