[4-[(4-cyanato-3,4-dimethyl-cyclohexa-2,5-dien-1-yl)methyl]-1,2-dimethyl-cyclohexa-2,5-dien-1-yl] cyanate

Systemtic Name: [4-[(4-cyanato-3,4-dimethyl-cyclohexa-2,5-dien-1-yl)methyl]-1,2-dimethyl-cyclohexa-2,5-dien-1-yl] cyanate Openeye Name: [4-[(4-cyanato-3,4-dimethyl-cyclohexa-2,5-dien-1-yl)methyl]-1,2-dimethyl-cyclohexa-2,5-dien-1-yl] cyanate CAS Name: cyanic acid [4-[(4-cyanato-3,4-dimethyl-1-cyclohexa-2,5-dienyl)methyl]-1,2-dimethyl-1-cyclohexa-2,5-dienyl] ester IUPAC Name: [4-[(4-cyanato-3,4-dimethylcyclohexa-2,5-dien-1-yl)methyl]-1,2-dimethylcyclohexa-2,5-dien-1-yl] cyanate Traditional Name: cyanic acid [4-[(4-cyanato-3,4-dimethyl-cyclohexa-2,5-dien-1-yl)methyl]-1,2-dimethyl-cyclohexa-2,5-dien-1-yl] ester Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C=CC1(C)OC#N)CC2C=CC(C(=C2)C)(C)OC#N

Isomeric SMILES

CC1=CC(C=CC1(C)OC#N)CC2C=CC(C(=C2)C)(C)OC#N

InChI

InChI=1S/C19H22N2O2/c1-14-9-16(5-7-18(14,3)22-12-20)11-17-6-8-19(4,23-13-21)15(2)10-17/h5-10,16-17H,11H2,1-4H3