1-[[2-[2,6-bis(oxidanylidene)piperidin-3-yl]-1-oxidanylidene-3H-isoindol-5-yl]methyl]-3-hexyl-urea

Systemtic Name: 1-[[2-[2,6-bis(oxidanylidene)piperidin-3-yl]-1-oxidanylidene-3H-isoindol-5-yl]methyl]-3-hexyl-urea Openeye Name: 1-[[2-(2,6-dioxo-3-piperidyl)-1-oxo-isoindolin-5-yl]methyl]-3-hexyl-urea CAS Name: 1-[[2-(2,6-dioxo-3-piperidinyl)-1-oxo-3H-isoindol-5-yl]methyl]-3-hexylurea IUPAC Name: 1-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]methyl]-3-hexylurea Traditional Name: 1-[[2-(2,6-diketo-3-piperidyl)-1-keto-isoindolin-5-yl]methyl]-3-hexyl-urea Formula: C21H28N4O4 MolecularWeight: 400.47142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)NCC1=CC2=C(C=C1)C(=O)N(C2)C3CCC(=O)NC3=O

Isomeric SMILES

CCCCCCNC(=O)NCC1=CC2=C(C=C1)C(=O)N(C2)C3CCC(=O)NC3=O

InChI

InChI=1S/C21H28N4O4/c1-2-3-4-5-10-22-21(29)23-12-14-6-7-16-15(11-14)13-25(20(16)28)17-8-9-18(26)24-19(17)27/h6-7,11,17H,2-5,8-10,12-13H2,1H3,(H2,22,23,29)(H,24,26,27)