3,7,11-tris(azanyl)-1,5,9-triazacyclododecane-2,6,10-trione

Systemtic Name: 3,7,11-tris(azanyl)-1,5,9-triazacyclododecane-2,6,10-trione Openeye Name: 3,7,11-triamino-1,5,9-triazacyclododecane-2,6,10-trione CAS Name: 3,7,11-triamino-1,5,9-triazacyclododecane-2,6,10-trione IUPAC Name: 3,7,11-triamino-1,5,9-triazacyclododecane-2,6,10-trione Traditional Name: 3,7,11-triamino-1,5,9-triazacyclododecane-2,6,10-trione Formula: C9H18N6O3 MolecularWeight: 258.27762

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NCC(C(=O)NCC(C(=O)N1)N)N)N

Isomeric SMILES

C1C(C(=O)NCC(C(=O)NCC(C(=O)N1)N)N)N

InChI

InChI=1S/C9H18N6O3/c10-4-1-13-8(17)5(11)2-15-9(18)6(12)3-14-7(4)16/h4-6H,1-3,10-12H2,(H,13,17)(H,14,16)(H,15,18)