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

Systemtic Name: 1,3,5-tris[(3-cyclohexyl-5-methyl-4-oxidanyl-phenyl)methyl]-1,3,5-triazinane-2,4,6-trione Openeye Name: 1,3,5-tris[(3-cyclohexyl-4-hydroxy-5-methyl-phenyl)methyl]-1,3,5-triazinane-2,4,6-trione CAS Name: 1,3,5-tris[(3-cyclohexyl-4-hydroxy-5-methylphenyl)methyl]-1,3,5-triazinane-2,4,6-trione IUPAC Name: 1,3,5-tris[(3-cyclohexyl-4-hydroxy-5-methylphenyl)methyl]-1,3,5-triazinane-2,4,6-trione Traditional Name: 1,3,5-tris(3-cyclohexyl-4-hydroxy-5-methyl-benzyl)isocyanuric acid Formula: C45H57N3O6 MolecularWeight: 735.95058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CN2C(=O)N(C(=O)N(C2=O)CC3=CC(=C(C(=C3)C4CCCCC4)O)C)CC5=CC(=C(C(=C5)C6CCCCC6)O)C)C7CCCCC7)O

Isomeric SMILES

CC1=C(C(=CC(=C1)CN2C(=O)N(C(=O)N(C2=O)CC3=CC(=C(C(=C3)C4CCCCC4)O)C)CC5=CC(=C(C(=C5)C6CCCCC6)O)C)C7CCCCC7)O

InChI

InChI=1S/C45H57N3O6/c1-28-19-31(22-37(40(28)49)34-13-7-4-8-14-34)25-46-43(52)47(26-32-20-29(2)41(50)38(23-32)35-15-9-5-10-16-35)45(54)48(44(46)53)27-33-21-30(3)42(51)39(24-33)36-17-11-6-12-18-36/h19-24,34-36,49-51H,4-18,25-27H2,1-3H3