1,6-diisocyanatohexane; 1-isocyanato-4-(4-isocyanato-3-methyl-phenyl)-2-methyl-benzene

Systemtic Name: 1,6-diisocyanatohexane; 1-isocyanato-4-(4-isocyanato-3-methyl-phenyl)-2-methyl-benzene Openeye Name: 1,6-diisocyanatohexane; 1-isocyanato-4-(4-isocyanato-3-methyl-phenyl)-2-methyl-benzene CAS Name: 1,6-diisocyanatohexane; 1-isocyanato-4-(4-isocyanato-3-methylphenyl)-2-methylbenzene IUPAC Name: 1,6-diisocyanatohexane; 1-isocyanato-4-(4-isocyanato-3-methylphenyl)-2-methylbenzene Traditional Name: 1,6-diisocyanatohexane; 1-isocyanato-4-(4-isocyanato-3-methyl-phenyl)-2-methyl-benzene Formula: C24H24N4O4 MolecularWeight: 432.47176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=C=O)C)N=C=O.C(CCCN=C=O)CCN=C=O

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=C=O)C)N=C=O.C(CCCN=C=O)CCN=C=O

InChI

InChI=1S/C16H12N2O2.C8H12N2O2/c1-11-7-13(3-5-15(11)17-9-19)14-4-6-16(18-10-20)12(2)8-14;11-7-9-5-3-1-2-4-6-10-8-12/h3-8H,1-2H3;1-6H2