N-[2,3-bis(chloranyl)phenyl]-1-[(4-bromophenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-[2,3-bis(chloranyl)phenyl]-1-[(4-bromophenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: 1-[(4-bromophenyl)methylsulfonyl]-N-(2,3-dichlorophenyl)piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)methylsulfonyl]-N-(2,3-dichlorophenyl)-4-piperidinecarboxamide IUPAC Name: 1-[(4-bromophenyl)methylsulfonyl]-N-(2,3-dichlorophenyl)piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzyl)sulfonyl-N-(2,3-dichlorophenyl)isonipecotamide Formula: C19H19BrCl2N2O3S MolecularWeight: 506.24076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C(=CC=C2)Cl)Cl)S(=O)(=O)CC3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C(=CC=C2)Cl)Cl)S(=O)(=O)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H19BrCl2N2O3S/c20-15-6-4-13(5-7-15)12-28(26,27)24-10-8-14(9-11-24)19(25)23-17-3-1-2-16(21)18(17)22/h1-7,14H,8-12H2,(H,23,25)