2,4-diisocyanato-1,3-bis[(4-isocyanatophenyl)methyl]-5-(phenylmethyl)benzene

Systemtic Name: 2,4-diisocyanato-1,3-bis[(4-isocyanatophenyl)methyl]-5-(phenylmethyl)benzene Openeye Name: 1-benzyl-2,4-diisocyanato-3,5-bis[(4-isocyanatophenyl)methyl]benzene CAS Name: 2,4-diisocyanato-1,3-bis[(4-isocyanatophenyl)methyl]-5-(phenylmethyl)benzene IUPAC Name: 1-benzyl-2,4-diisocyanato-3,5-bis[(4-isocyanatophenyl)methyl]benzene Traditional Name: 1-benzyl-2,4-diisocyanato-3,5-bis(4-isocyanatobenzyl)benzene Formula: C31H20N4O4 MolecularWeight: 512.5149

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=C(C(=C2N=C=O)CC3=CC=C(C=C3)N=C=O)N=C=O)CC4=CC=C(C=C4)N=C=O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=C(C(=C2N=C=O)CC3=CC=C(C=C3)N=C=O)N=C=O)CC4=CC=C(C=C4)N=C=O

InChI

InChI=1S/C31H20N4O4/c36-18-32-27-10-6-23(7-11-27)15-26-17-25(14-22-4-2-1-3-5-22)30(34-20-38)29(31(26)35-21-39)16-24-8-12-28(13-9-24)33-19-37/h1-13,17H,14-16H2