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

Systemtic Name: (4-bromophenyl) 2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: (4-bromophenyl) 2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-cyanophenyl)sulfonyl-methylamino]acetic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 2-[(4-cyanophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetic acid (4-bromophenyl) ester Formula: C16H13BrN2O4S MolecularWeight: 409.25442

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC1=CC=C(C=C1)Br)S(=O)(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CN(CC(=O)OC1=CC=C(C=C1)Br)S(=O)(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H13BrN2O4S/c1-19(11-16(20)23-14-6-4-13(17)5-7-14)24(21,22)15-8-2-12(10-18)3-9-15/h2-9H,11H2,1H3