[4-[(4-cyanato-3,5-dimethyl-phenyl)methyl]-2,6-dimethyl-phenyl] cyanate; [4-[2-(4-cyanatophenyl)propan-2-yl]phenyl] cyanate

Systemtic Name: [4-[(4-cyanato-3,5-dimethyl-phenyl)methyl]-2,6-dimethyl-phenyl] cyanate; [4-[2-(4-cyanatophenyl)propan-2-yl]phenyl] cyanate Openeye Name: [4-[(4-cyanato-3,5-dimethyl-phenyl)methyl]-2,6-dimethyl-phenyl] cyanate; [4-[1-(4-cyanatophenyl)-1-methyl-ethyl]phenyl] cyanate CAS Name: cyanic acid [4-[(4-cyanato-3,5-dimethylphenyl)methyl]-2,6-dimethylphenyl] ester; cyanic acid [4-[2-(4-cyanatophenyl)propan-2-yl]phenyl] ester IUPAC Name: [4-[(4-cyanato-3,5-dimethylphenyl)methyl]-2,6-dimethylphenyl] cyanate; [4-[2-(4-cyanatophenyl)propan-2-yl]phenyl] cyanate Traditional Name: cyanic acid [4-(4-cyanato-3,5-dimethyl-benzyl)-2,6-dimethyl-phenyl] ester; cyanic acid [4-[1-(4-cyanatophenyl)-1-methyl-ethyl]phenyl] ester Formula: C36H32N4O4 MolecularWeight: 584.66368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC#N)C)CC2=CC(=C(C(=C2)C)OC#N)C.CC(C)(C1=CC=C(C=C1)OC#N)C2=CC=C(C=C2)OC#N

Isomeric SMILES

CC1=CC(=CC(=C1OC#N)C)CC2=CC(=C(C(=C2)C)OC#N)C.CC(C)(C1=CC=C(C=C1)OC#N)C2=CC=C(C=C2)OC#N

InChI

InChI=1S/C19H18N2O2.C17H14N2O2/c1-12-5-16(6-13(2)18(12)22-10-20)9-17-7-14(3)19(23-11-21)15(4)8-17;1-17(2,13-3-7-15(8-4-13)20-11-18)14-5-9-16(10-6-14)21-12-19/h5-8H,9H2,1-4H3;3-10H,1-2H3