tert-butyl N-[3-(2-oxidanylideneoctyl)pyridin-2-yl]carbamate

Systemtic Name: tert-butyl N-[3-(2-oxidanylideneoctyl)pyridin-2-yl]carbamate Openeye Name: tert-butyl N-[3-(2-oxooctyl)-2-pyridyl]carbamate CAS Name: N-[3-(2-oxooctyl)-2-pyridinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(2-oxooctyl)pyridin-2-yl]carbamate Traditional Name: N-[3-(2-ketooctyl)-2-pyridyl]carbamic acid tert-butyl ester Formula: C18H28N2O3 MolecularWeight: 320.42652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)CC1=C(N=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCC(=O)CC1=C(N=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C18H28N2O3/c1-5-6-7-8-11-15(21)13-14-10-9-12-19-16(14)20-17(22)23-18(2,3)4/h9-10,12H,5-8,11,13H2,1-4H3,(H,19,20,22)