3,5-bis(6-isocyanatohexyl)-4-oxidanylidene-1,3,4-oxadiazinan-4-ium-2,6-dione

Systemtic Name: 3,5-bis(6-isocyanatohexyl)-4-oxidanylidene-1,3,4-oxadiazinan-4-ium-2,6-dione Openeye Name: 3,5-bis(6-isocyanatohexyl)-4-oxo-1,3,4-oxadiazinan-4-ium-2,6-dione CAS Name: 3,5-bis(6-isocyanatohexyl)-4-oxo-1,3,4-oxadiazinan-4-ium-2,6-dione IUPAC Name: 3,5-bis(6-isocyanatohexyl)-4-oxo-1,3,4-oxadiazinan-4-ium-2,6-dione Traditional Name: 3,5-bis(6-isocyanatohexyl)-4-keto-1,3,4-oxadiazinan-4-ium-2,6-quinone Formula: C17H25N4O6+ MolecularWeight: 381.4036

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCN=C=O)CCC1C(=O)OC(=O)N([N+]1=O)CCCCCCN=C=O

Isomeric SMILES

C(CCCN=C=O)CCC1C(=O)OC(=O)N([N+]1=O)CCCCCCN=C=O

InChI

InChI=1S/C17H25N4O6/c22-13-18-10-6-2-1-5-9-15-16(24)27-17(25)20(21(15)26)12-8-4-3-7-11-19-14-23/h15H,1-12H2/q+1