N-[2,5-bis(fluoranyl)phenyl]-1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[2,5-bis(fluoranyl)phenyl]-1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(2,5-difluorophenyl)-1-indan-5-ylsulfonyl-piperidine-4-carboxamide CAS Name: N-(2,5-difluorophenyl)-1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(2,5-difluorophenyl)-1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(2,5-difluorophenyl)-1-indan-5-ylsulfonyl-isonipecotamide Formula: C21H22F2N2O3S MolecularWeight: 420.472786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NC4=C(C=CC(=C4)F)F

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NC4=C(C=CC(=C4)F)F

InChI

InChI=1S/C21H22F2N2O3S/c22-17-5-7-19(23)20(13-17)24-21(26)15-8-10-25(11-9-15)29(27,28)18-6-4-14-2-1-3-16(14)12-18/h4-7,12-13,15H,1-3,8-11H2,(H,24,26)