1-(4-bromophenyl)sulfonyl-N-[3-(2-fluoranylphenoxy)propyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-[3-(2-fluoranylphenoxy)propyl]piperidine-3-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-[3-(2-fluorophenoxy)propyl]piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-[3-(2-fluorophenoxy)propyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-[3-(2-fluorophenoxy)propyl]piperidine-3-carboxamide Traditional Name: 1-brosyl-N-[3-(2-fluorophenoxy)propyl]nipecotamide Formula: C21H24BrFN2O4S MolecularWeight: 499.393663

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NCCCOC3=CC=CC=C3F

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NCCCOC3=CC=CC=C3F

InChI

InChI=1S/C21H24BrFN2O4S/c22-17-8-10-18(11-9-17)30(27,28)25-13-3-5-16(15-25)21(26)24-12-4-14-29-20-7-2-1-6-19(20)23/h1-2,6-11,16H,3-5,12-15H2,(H,24,26)