1,3-bis[2-(3-isocyanatocyclohexyl)ethyl]-1,3,5-triazinane-2,4,6-trione

Systemtic Name: 1,3-bis[2-(3-isocyanatocyclohexyl)ethyl]-1,3,5-triazinane-2,4,6-trione Openeye Name: 1,3-bis[2-(3-isocyanatocyclohexyl)ethyl]-1,3,5-triazinane-2,4,6-trione CAS Name: 1,3-bis[2-(3-isocyanatocyclohexyl)ethyl]-1,3,5-triazinane-2,4,6-trione IUPAC Name: 1,3-bis[2-(3-isocyanatocyclohexyl)ethyl]-1,3,5-triazinane-2,4,6-trione Traditional Name: 1,3-bis[2-(3-isocyanatocyclohexyl)ethyl]isocyanuric acid Formula: C21H29N5O5 MolecularWeight: 431.48546

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)N=C=O)CCN2C(=O)NC(=O)N(C2=O)CCC3CCCC(C3)N=C=O

Isomeric SMILES

C1CC(CC(C1)N=C=O)CCN2C(=O)NC(=O)N(C2=O)CCC3CCCC(C3)N=C=O

InChI

InChI=1S/C21H29N5O5/c27-13-22-17-5-1-3-15(11-17)7-9-25-19(29)24-20(30)26(21(25)31)10-8-16-4-2-6-18(12-16)23-14-28/h15-18H,1-12H2,(H,24,29,30)