[2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethyl] 2-(4-bromanylphenoxy)ethanoate

Systemtic Name: [2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethyl] 2-(4-bromanylphenoxy)ethanoate Openeye Name: [2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl] 2-(4-bromophenoxy)acetate CAS Name: 2-(4-bromophenoxy)acetic acid [2-oxo-2-[4-(1-piperidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylsulfonylanilino)ethyl] 2-(4-bromophenoxy)acetate Traditional Name: 2-(4-bromophenoxy)acetic acid [2-keto-2-(4-piperidinosulfonylanilino)ethyl] ester Formula: C21H23BrN2O6S MolecularWeight: 511.38612

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC(=O)COC3=CC=C(C=C3)Br

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC(=O)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H23BrN2O6S/c22-16-4-8-18(9-5-16)29-15-21(26)30-14-20(25)23-17-6-10-19(11-7-17)31(27,28)24-12-2-1-3-13-24/h4-11H,1-3,12-15H2,(H,23,25)