tert-butyl 4-(1-oxidanidylpyridin-1-ium-2-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(1-oxidanidylpyridin-1-ium-2-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(1-oxidopyridin-1-ium-2-yl)piperidine-1-carboxylate CAS Name: 4-(1-oxido-2-pyridin-1-iumyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1-oxidopyridin-1-ium-2-yl)piperidine-1-carboxylate Traditional Name: 4-(1-oxidopyridin-1-ium-2-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C15H22N2O3 MolecularWeight: 278.34678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C15H22N2O3/c1-15(2,3)20-14(18)16-10-7-12(8-11-16)13-6-4-5-9-17(13)19/h4-6,9,12H,7-8,10-11H2,1-3H3