1,3-diisocyanato-5-methyl-benzene; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene

Systemtic Name: 1,3-diisocyanato-5-methyl-benzene; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene Openeye Name: 1,3-diisocyanato-5-methyl-benzene; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene CAS Name: 1,3-diisocyanato-5-methylbenzene; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene IUPAC Name: 1,3-diisocyanato-5-methylbenzene; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene Traditional Name: 1,3-diisocyanato-5-methyl-benzene; 1-isocyanato-4-(4-isocyanatobenzyl)benzene Formula: C24H16N4O4 MolecularWeight: 424.40824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N=C=O)N=C=O.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O

Isomeric SMILES

CC1=CC(=CC(=C1)N=C=O)N=C=O.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O

InChI

InChI=1S/C15H10N2O2.C9H6N2O2/c18-10-16-14-5-1-12(2-6-14)9-13-3-7-15(8-4-13)17-11-19;1-7-2-8(10-5-12)4-9(3-7)11-6-13/h1-8H,9H2;2-4H,1H3