butyl (1S,5R)-8-methyl-8-azabicyclo[3.2.1]octane-3-carboxylate; ethanedioic acid

Systemtic Name: butyl (1S,5R)-8-methyl-8-azabicyclo[3.2.1]octane-3-carboxylate; ethanedioic acid Openeye Name: butyl (1S,5R)-8-methyl-8-azabicyclo[3.2.1]octane-3-carboxylate; oxalic acid CAS Name: (1S,5R)-8-methyl-8-azabicyclo[3.2.1]octane-3-carboxylic acid butyl ester; oxalic acid IUPAC Name: butyl (1S,5R)-8-methyl-8-azabicyclo[3.2.1]octane-3-carboxylate; oxalic acid Traditional Name: (1S,5R)-8-methyl-8-azabicyclo[3.2.1]octane-3-carboxylic acid butyl ester; oxalic acid Formula: C15H25NO6 MolecularWeight: 315.3621

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CC2CCC(C1)N2C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCOC(=O)C1C[C@H]2CC[C@@H](C1)N2C.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H23NO2.C2H2O4/c1-3-4-7-16-13(15)10-8-11-5-6-12(9-10)14(11)2;3-1(4)2(5)6/h10-12H,3-9H2,1-2H3;(H,3,4)(H,5,6)/t10?,11-,12+;