N-butyl-4-[2-(dodecanoylamino)-3-methyl-pentanoyl]piperazine-1-carboxamide

Systemtic Name: N-butyl-4-[2-(dodecanoylamino)-3-methyl-pentanoyl]piperazine-1-carboxamide Openeye Name: N-butyl-4-[2-(dodecanoylamino)-3-methyl-pentanoyl]piperazine-1-carboxamide CAS Name: N-butyl-4-[3-methyl-1-oxo-2-(1-oxododecylamino)pentyl]-1-piperazinecarboxamide IUPAC Name: N-butyl-4-[2-(dodecanoylamino)-3-methylpentanoyl]piperazine-1-carboxamide Traditional Name: N-butyl-4-[2-(lauroylamino)-3-methyl-pentanoyl]piperazine-1-carboxamide Formula: C27H52N4O3 MolecularWeight: 480.72678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(C(C)CC)C(=O)N1CCN(CC1)C(=O)NCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)NC(C(C)CC)C(=O)N1CCN(CC1)C(=O)NCCCC

InChI

InChI=1S/C27H52N4O3/c1-5-8-10-11-12-13-14-15-16-17-24(32)29-25(23(4)7-3)26(33)30-19-21-31(22-20-30)27(34)28-18-9-6-2/h23,25H,5-22H2,1-4H3,(H,28,34)(H,29,32)