bromanylmethane; (8-methyl-8-azabicyclo[3.2.1]octan-6-yl) (9-oxidanylxanthen-9-yl) carbonate

Systemtic Name: bromanylmethane; (8-methyl-8-azabicyclo[3.2.1]octan-6-yl) (9-oxidanylxanthen-9-yl) carbonate Openeye Name: bromomethane; (9-hydroxyxanthen-9-yl) (8-methyl-8-azabicyclo[3.2.1]octan-6-yl) carbonate CAS Name: bromomethane; carbonic acid (9-hydroxy-9-xanthenyl) (8-methyl-8-azabicyclo[3.2.1]octan-6-yl) ester IUPAC Name: bromomethane; (9-hydroxyxanthen-9-yl) (8-methyl-8-azabicyclo[3.2.1]octan-6-yl) carbonate Traditional Name: bromomethane; carbonic acid (9-hydroxyxanthen-9-yl) (8-methyl-8-azabicyclo[3.2.1]octan-6-yl) ester Formula: C23H26BrNO5 MolecularWeight: 476.36024

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCCC1C(C2)OC(=O)OC3(C4=CC=CC=C4OC5=CC=CC=C53)O.CBr

Isomeric SMILES

CN1C2CCCC1C(C2)OC(=O)OC3(C4=CC=CC=C4OC5=CC=CC=C53)O.CBr

InChI

InChI=1S/C22H23NO5.CH3Br/c1-23-14-7-6-10-17(23)20(13-14)27-21(24)28-22(25)15-8-2-4-11-18(15)26-19-12-5-3-9-16(19)22;1-2/h2-5,8-9,11-12,14,17,20,25H,6-7,10,13H2,1H3;1H3