[4-[1-(4-cyanato-3-methyl-phenyl)cyclohexyl]-2-methyl-phenyl] cyanate

Systemtic Name: [4-[1-(4-cyanato-3-methyl-phenyl)cyclohexyl]-2-methyl-phenyl] cyanate Openeye Name: [4-[1-(4-cyanato-3-methyl-phenyl)cyclohexyl]-2-methyl-phenyl] cyanate CAS Name: cyanic acid [4-[1-(4-cyanato-3-methylphenyl)cyclohexyl]-2-methylphenyl] ester IUPAC Name: [4-[1-(4-cyanato-3-methylphenyl)cyclohexyl]-2-methylphenyl] cyanate Traditional Name: cyanic acid [4-[1-(4-cyanato-3-methyl-phenyl)cyclohexyl]-2-methyl-phenyl] ester Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2(CCCCC2)C3=CC(=C(C=C3)OC#N)C)OC#N

Isomeric SMILES

CC1=C(C=CC(=C1)C2(CCCCC2)C3=CC(=C(C=C3)OC#N)C)OC#N

InChI

InChI=1S/C22H22N2O2/c1-16-12-18(6-8-20(16)25-14-23)22(10-4-3-5-11-22)19-7-9-21(26-15-24)17(2)13-19/h6-9,12-13H,3-5,10-11H2,1-2H3