1,6-diisocyanato-2,4,4-trimethyl-heptane

Systemtic Name: 1,6-diisocyanato-2,4,4-trimethyl-heptane Openeye Name: 1,6-diisocyanato-2,4,4-trimethyl-heptane CAS Name: 1,6-diisocyanato-2,4,4-trimethylheptane IUPAC Name: 1,6-diisocyanato-2,4,4-trimethylheptane Traditional Name: 1,6-diisocyanato-2,4,4-trimethyl-heptane Formula: C12H20N2O2 MolecularWeight: 224.2994

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(C)CC(C)N=C=O)CN=C=O

Isomeric SMILES

CC(CC(C)(C)CC(C)N=C=O)CN=C=O

InChI

InChI=1S/C12H20N2O2/c1-10(7-13-8-15)5-12(3,4)6-11(2)14-9-16/h10-11H,5-7H2,1-4H3