1-(3,5-diisocyanato-2-methyl-phenyl)hexane-1,6-diol

Systemtic Name: 1-(3,5-diisocyanato-2-methyl-phenyl)hexane-1,6-diol Openeye Name: 1-(3,5-diisocyanato-2-methyl-phenyl)hexane-1,6-diol CAS Name: 1-(3,5-diisocyanato-2-methylphenyl)hexane-1,6-diol IUPAC Name: 1-(3,5-diisocyanato-2-methylphenyl)hexane-1,6-diol Traditional Name: 1-(3,5-diisocyanato-2-methyl-phenyl)hexane-1,6-diol Formula: C15H18N2O4 MolecularWeight: 290.31442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(CCCCCO)O)N=C=O)N=C=O

Isomeric SMILES

CC1=C(C=C(C=C1C(CCCCCO)O)N=C=O)N=C=O

InChI

InChI=1S/C15H18N2O4/c1-11-13(15(21)5-3-2-4-6-18)7-12(16-9-19)8-14(11)17-10-20/h7-8,15,18,21H,2-6H2,1H3