2-[4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[[4-(4-bromophenyl)-4-hydroxy-1-piperidyl]sulfonyl]benzonitrile CAS Name: 2-[[4-(4-bromophenyl)-4-hydroxy-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(4-bromophenyl)-4-hydroxypiperidin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(4-bromophenyl)-4-hydroxy-piperidino]sulfonylbenzonitrile Formula: C18H17BrN2O3S MolecularWeight: 421.30818

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=CC=C3C#N

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Br)O)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C18H17BrN2O3S/c19-16-7-5-15(6-8-16)18(22)9-11-21(12-10-18)25(23,24)17-4-2-1-3-14(17)13-20/h1-8,22H,9-12H2