tert-butyl N-[11-[2,5-bis(oxidanylidene)pyrrol-1-yl]undecanoylamino]carbamate

Systemtic Name: tert-butyl N-[11-[2,5-bis(oxidanylidene)pyrrol-1-yl]undecanoylamino]carbamate Openeye Name: tert-butyl N-[11-(2,5-dioxopyrrol-1-yl)undecanoylamino]carbamate CAS Name: N-[[11-(2,5-dioxo-1-pyrrolyl)-1-oxoundecyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[11-(2,5-dioxopyrrol-1-yl)undecanoylamino]carbamate Traditional Name: N-(11-maleimidoundecanoylamino)carbamic acid tert-butyl ester Formula: C20H33N3O5 MolecularWeight: 395.49312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NNC(=O)CCCCCCCCCCN1C(=O)C=CC1=O

Isomeric SMILES

CC(C)(C)OC(=O)NNC(=O)CCCCCCCCCCN1C(=O)C=CC1=O

InChI

InChI=1S/C20H33N3O5/c1-20(2,3)28-19(27)22-21-16(24)12-10-8-6-4-5-7-9-11-15-23-17(25)13-14-18(23)26/h13-14H,4-12,15H2,1-3H3,(H,21,24)(H,22,27)