Chemical Component Summary

Name(3-exo)-N-(4-amino-4'-fluoro[1,1'-biphenyl]-3-yl)-8-oxabicyclo[3.2.1]octane-3-carboxamide
Identifiers(1~{S},5~{R})-~{N}-[2-azanyl-5-(4-fluorophenyl)phenyl]-8-oxabicyclo[3.2.1]octane-3-carboxamide
FormulaC20 H21 F N2 O2
Molecular Weight340.391
TypeNON-POLYMER
Isomeric SMILESc1cc(ccc1c2ccc(c(c2)NC(=O)C3C[C@H]4CC[C@@H](C3)O4)N)F
InChIInChI=1S/C20H21FN2O2/c21-15-4-1-12(2-5-15)13-3-8-18(22)19(11-13)23-20(24)14-9-16-6-7-17(10-14)25-16/h1-5,8,11,14,16-17H,6-7,9-10,22H2,(H,23,24)/t14-,16-,17+
InChIKeySBKJRDAJADZOCH-XGBSXSJOSA-N

Chemical Details

Formal Charge0
Atom Count46
Chiral Atom Count3
Bond Count49
Aromatic Bond Count12