tert-butyl 9-methyl-9-oxidanyl-7-(phenylmethyl)-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: tert-butyl 9-methyl-9-oxidanyl-7-(phenylmethyl)-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate Openeye Name: tert-butyl 7-benzyl-9-hydroxy-9-methyl-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate CAS Name: 9-hydroxy-9-methyl-7-(phenylmethyl)-3,7-diazabicyclo[3.3.1]nonane-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-benzyl-9-hydroxy-9-methyl-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate Traditional Name: 7-benzyl-9-hydroxy-9-methyl-3,7-diazabicyclo[3.3.1]nonane-3-carboxylic acid tert-butyl ester Formula: C20H30N2O3 MolecularWeight: 346.4638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CN(CC1CN(C2)C(=O)OC(C)(C)C)CC3=CC=CC=C3)O

Isomeric SMILES

CC1(C2CN(CC1CN(C2)C(=O)OC(C)(C)C)CC3=CC=CC=C3)O

InChI

InChI=1S/C20H30N2O3/c1-19(2,3)25-18(23)22-13-16-11-21(10-15-8-6-5-7-9-15)12-17(14-22)20(16,4)24/h5-9,16-17,24H,10-14H2,1-4H3