1,3,5-tris[(2-isocyanatocyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione

Systemtic Name: 1,3,5-tris[(2-isocyanatocyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione Openeye Name: 1,3,5-tris[(2-isocyanatocyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione CAS Name: 1,3,5-tris[(2-isocyanatocyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione IUPAC Name: 1,3,5-tris[(2-isocyanatocyclohexyl)methyl]-1,3,5-triazinane-2,4,6-trione Traditional Name: 1,3,5-tris[(2-isocyanatocyclohexyl)methyl]isocyanuric acid Formula: C27H36N6O6 MolecularWeight: 540.61134

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)CN2C(=O)N(C(=O)N(C2=O)CC3CCCCC3N=C=O)CC4CCCCC4N=C=O)N=C=O

Isomeric SMILES

C1CCC(C(C1)CN2C(=O)N(C(=O)N(C2=O)CC3CCCCC3N=C=O)CC4CCCCC4N=C=O)N=C=O

InChI

InChI=1S/C27H36N6O6/c34-16-28-22-10-4-1-7-19(22)13-31-25(37)32(14-20-8-2-5-11-23(20)29-17-35)27(39)33(26(31)38)15-21-9-3-6-12-24(21)30-18-36/h19-24H,1-15H2