4-octyl-2,3-bis(oxidanylidene)-N-(2-oxidanylidene-1-phenyl-ethyl)piperazine-1-carboxamide

Systemtic Name: 4-octyl-2,3-bis(oxidanylidene)-N-(2-oxidanylidene-1-phenyl-ethyl)piperazine-1-carboxamide Openeye Name: 4-octyl-2,3-dioxo-N-(2-oxo-1-phenyl-ethyl)piperazine-1-carboxamide CAS Name: 4-octyl-2,3-dioxo-N-(2-oxo-1-phenylethyl)-1-piperazinecarboxamide IUPAC Name: 4-octyl-2,3-dioxo-N-(2-oxo-1-phenylethyl)piperazine-1-carboxamide Traditional Name: 2,3-diketo-N-(2-keto-1-phenyl-ethyl)-4-octyl-piperazine-1-carboxamide Formula: C21H29N3O4 MolecularWeight: 387.47266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1CCN(C(=O)C1=O)C(=O)NC(C=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCN1CCN(C(=O)C1=O)C(=O)NC(C=O)C2=CC=CC=C2

InChI

InChI=1S/C21H29N3O4/c1-2-3-4-5-6-10-13-23-14-15-24(20(27)19(23)26)21(28)22-18(16-25)17-11-8-7-9-12-17/h7-9,11-12,16,18H,2-6,10,13-15H2,1H3,(H,22,28)