6,7,7-triisocyanato-1,8,10-triazabicyclo[6.3.1]dodecane-9,11,12-trione

Systemtic Name: 6,7,7-triisocyanato-1,8,10-triazabicyclo[6.3.1]dodecane-9,11,12-trione Openeye Name: 6,7,7-triisocyanato-1,8,10-triazabicyclo[6.3.1]dodecane-9,11,12-trione CAS Name: 6,7,7-triisocyanato-1,8,10-triazabicyclo[6.3.1]dodecane-9,11,12-trione IUPAC Name: 6,7,7-triisocyanato-1,8,10-triazabicyclo[6.3.1]dodecane-9,11,12-trione Traditional Name: 6,7,7-triisocyanato-1,8,10-triazabicyclo[6.3.1]dodecane-9,11,12-trione Formula: C12H10N6O6 MolecularWeight: 334.2444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN2C(=O)NC(=O)N(C2=O)C(C(C1)N=C=O)(N=C=O)N=C=O

Isomeric SMILES

C1CCN2C(=O)NC(=O)N(C2=O)C(C(C1)N=C=O)(N=C=O)N=C=O

InChI

InChI=1S/C12H10N6O6/c19-5-13-8-3-1-2-4-17-9(22)16-10(23)18(11(17)24)12(8,14-6-20)15-7-21/h8H,1-4H2,(H,16,22,23)