2,4,6-tris(6-isocyanatohexyl)cyclohexane-1,3,5-trione

Systemtic Name: 2,4,6-tris(6-isocyanatohexyl)cyclohexane-1,3,5-trione Openeye Name: 2,4,6-tris(6-isocyanatohexyl)cyclohexane-1,3,5-trione CAS Name: 2,4,6-tris(6-isocyanatohexyl)cyclohexane-1,3,5-trione IUPAC Name: 2,4,6-tris(6-isocyanatohexyl)cyclohexane-1,3,5-trione Traditional Name: 2,4,6-tris(6-isocyanatohexyl)cyclohexane-1,3,5-trione Formula: C27H39N3O6 MolecularWeight: 501.61506

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCN=C=O)CCC1C(=O)C(C(=O)C(C1=O)CCCCCCN=C=O)CCCCCCN=C=O

Isomeric SMILES

C(CCCN=C=O)CCC1C(=O)C(C(=O)C(C1=O)CCCCCCN=C=O)CCCCCCN=C=O

InChI

InChI=1S/C27H39N3O6/c31-19-28-16-10-4-1-7-13-22-25(34)23(14-8-2-5-11-17-29-20-32)27(36)24(26(22)35)15-9-3-6-12-18-30-21-33/h22-24H,1-18H2