2-[4-[4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]sulfonylphenoxy]-6-chloranyl-benzenecarbonitrile

Systemtic Name: 2-[4-[4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]sulfonylphenoxy]-6-chloranyl-benzenecarbonitrile Openeye Name: 2-[4-[[4-(4-bromophenyl)-4-hydroxy-1-piperidyl]sulfonyl]phenoxy]-6-chloro-benzonitrile CAS Name: 2-[4-[[4-(4-bromophenyl)-4-hydroxy-1-piperidinyl]sulfonyl]phenoxy]-6-chlorobenzonitrile IUPAC Name: 2-[4-[4-(4-bromophenyl)-4-hydroxypiperidin-1-yl]sulfonylphenoxy]-6-chlorobenzonitrile Traditional Name: 2-[4-[4-(4-bromophenyl)-4-hydroxy-piperidino]sulfonylphenoxy]-6-chloro-benzonitrile Formula: C24H20BrClN2O4S MolecularWeight: 547.8486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Br)O)S(=O)(=O)C3=CC=C(C=C3)OC4=C(C(=CC=C4)Cl)C#N

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Br)O)S(=O)(=O)C3=CC=C(C=C3)OC4=C(C(=CC=C4)Cl)C#N

InChI

InChI=1S/C24H20BrClN2O4S/c25-18-6-4-17(5-7-18)24(29)12-14-28(15-13-24)33(30,31)20-10-8-19(9-11-20)32-23-3-1-2-22(26)21(23)16-27/h1-11,29H,12-15H2