O1-(4-azidobutyl) O3-(3-pyridin-3-ylpropyl) 2,2-diethylpropanedioate

Systemtic Name: O1-(4-azidobutyl) O3-(3-pyridin-3-ylpropyl) 2,2-diethylpropanedioate Openeye Name: O1-(4-azidobutyl) O3-[3-(3-pyridyl)propyl] 2,2-diethylpropanedioate CAS Name: 2,2-diethylpropanedioic acid O1-(4-azidobutyl) ester O3-[3-(3-pyridinyl)propyl] ester IUPAC Name: 1-O-(4-azidobutyl) 3-O-(3-pyridin-3-ylpropyl) 2,2-diethylpropanedioate Traditional Name: 2,2-diethylmalonic acid O1-(4-azidobutyl) ester O3-[3-(3-pyridyl)propyl] ester Formula: C19H28N4O4 MolecularWeight: 376.45002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)OCCCCN=[N+]=[N-])C(=O)OCCCC1=CN=CC=C1

Isomeric SMILES

CCC(CC)(C(=O)OCCCCN=[N+]=[N-])C(=O)OCCCC1=CN=CC=C1

InChI

InChI=1S/C19H28N4O4/c1-3-19(4-2,17(24)26-13-6-5-12-22-23-20)18(25)27-14-8-10-16-9-7-11-21-15-16/h7,9,11,15H,3-6,8,10,12-14H2,1-2H3