[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl] 4-bromanylbenzoate

Systemtic Name: [2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl] 4-bromanylbenzoate Openeye Name: [2-oxo-2-[3-(1-piperidylsulfonyl)anilino]ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-oxo-2-[3-(1-piperidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(3-piperidin-1-ylsulfonylanilino)ethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-keto-2-(3-piperidinosulfonylanilino)ethyl] ester Formula: C20H21BrN2O5S MolecularWeight: 481.36014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21BrN2O5S/c21-16-9-7-15(8-10-16)20(25)28-14-19(24)22-17-5-4-6-18(13-17)29(26,27)23-11-2-1-3-12-23/h4-10,13H,1-3,11-12,14H2,(H,22,24)