N-(4-bromanyl-3-chloranyl-phenyl)-1-[(3-bromophenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(4-bromanyl-3-chloranyl-phenyl)-1-[(3-bromophenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-(4-bromo-3-chloro-phenyl)-1-[(3-bromophenyl)methylsulfonyl]piperidine-4-carboxamide CAS Name: N-(4-bromo-3-chlorophenyl)-1-[(3-bromophenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(4-bromo-3-chlorophenyl)-1-[(3-bromophenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: 1-(3-bromobenzyl)sulfonyl-N-(4-bromo-3-chloro-phenyl)isonipecotamide Formula: C19H19Br2ClN2O3S MolecularWeight: 550.69176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19Br2ClN2O3S/c20-15-3-1-2-13(10-15)12-28(26,27)24-8-6-14(7-9-24)19(25)23-16-4-5-17(21)18(22)11-16/h1-5,10-11,14H,6-9,12H2,(H,23,25)