N'-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-N'-cyclopentyl-N-pyridin-2-yl-butanediamide

Systemtic Name: N'-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-N'-cyclopentyl-N-pyridin-2-yl-butanediamide Openeye Name: N'-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]-N'-cyclopentyl-N-(2-pyridyl)butanediamide CAS Name: N'-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-N'-cyclopentyl-N-(2-pyridinyl)butanediamide IUPAC Name: N'-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-N'-cyclopentyl-N-pyridin-2-ylbutanediamide Traditional Name: N'-cyclopentyl-N'-[2-keto-2-(piperonylamino)ethyl]-N-(2-pyridyl)succinamide Formula: C24H28N4O5 MolecularWeight: 452.50292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)CCC(=O)NC4=CC=CC=N4

Isomeric SMILES

C1CCC(C1)N(CC(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)CCC(=O)NC4=CC=CC=N4

InChI

InChI=1S/C24H28N4O5/c29-22(27-21-7-3-4-12-25-21)10-11-24(31)28(18-5-1-2-6-18)15-23(30)26-14-17-8-9-19-20(13-17)33-16-32-19/h3-4,7-9,12-13,18H,1-2,5-6,10-11,14-16H2,(H,26,30)(H,25,27,29)