1-isocyanatoethyl 2,6-diisocyanatohexanoate

Systemtic Name: 1-isocyanatoethyl 2,6-diisocyanatohexanoate Openeye Name: 1-isocyanatoethyl 2,6-diisocyanatohexanoate CAS Name: 2,6-diisocyanatohexanoic acid 1-isocyanatoethyl ester IUPAC Name: 1-isocyanatoethyl 2,6-diisocyanatohexanoate Traditional Name: 2,6-diisocyanatohexanoic acid 1-isocyanatoethyl ester Formula: C11H13N3O5 MolecularWeight: 267.23802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(N=C=O)OC(=O)C(CCCCN=C=O)N=C=O

Isomeric SMILES

CC(N=C=O)OC(=O)C(CCCCN=C=O)N=C=O

InChI

InChI=1S/C11H13N3O5/c1-9(13-7-16)19-11(18)10(14-8-17)4-2-3-5-12-6-15/h9-10H,2-5H2,1H3