1,2-bis[(4-isocyanatophenyl)methyl]benzene cyanate

Systemtic Name: 1,2-bis[(4-isocyanatophenyl)methyl]benzene cyanate Openeye Name: 1,2-bis[(4-isocyanatophenyl)methyl]benzene cyanate CAS Name: 1,2-bis[(4-isocyanatophenyl)methyl]benzene cyanate IUPAC Name: 1,2-bis[(4-isocyanatophenyl)methyl]benzene cyanate Traditional Name: 1,2-bis(4-isocyanatobenzyl)benzene cyanate Formula: C23H16N3O3- MolecularWeight: 382.39144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=CC=C(C=C2)N=C=O)CC3=CC=C(C=C3)N=C=O.C(#N)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CC2=CC=C(C=C2)N=C=O)CC3=CC=C(C=C3)N=C=O.C(#N)[O-]

InChI

InChI=1S/C22H16N2O2.CHNO/c25-15-23-21-9-5-17(6-10-21)13-19-3-1-2-4-20(19)14-18-7-11-22(12-8-18)24-16-26;2-1-3/h1-12H,13-14H2;3H/p-1