2-[5-octyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]-3-oxidanylidene-3-piperazin-1-yl-propanamide

Systemtic Name: 2-[5-octyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]-3-oxidanylidene-3-piperazin-1-yl-propanamide Openeye Name: 2-(5-octyl-2,4,6-trioxo-hexahydropyrimidin-5-yl)-3-oxo-3-piperazin-1-yl-propanamide CAS Name: 2-(5-octyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-oxo-3-(1-piperazinyl)propanamide IUPAC Name: 2-(5-octyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-oxo-3-piperazin-1-ylpropanamide Traditional Name: 3-keto-3-piperazino-2-(2,4,6-triketo-5-octyl-hexahydropyrimidin-5-yl)propionamide Formula: C19H31N5O5 MolecularWeight: 409.47994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(C(=O)NC(=O)NC1=O)C(C(=O)N)C(=O)N2CCNCC2

Isomeric SMILES

CCCCCCCCC1(C(=O)NC(=O)NC1=O)C(C(=O)N)C(=O)N2CCNCC2

InChI

InChI=1S/C19H31N5O5/c1-2-3-4-5-6-7-8-19(16(27)22-18(29)23-17(19)28)13(14(20)25)15(26)24-11-9-21-10-12-24/h13,21H,2-12H2,1H3,(H2,20,25)(H2,22,23,27,28,29)