2,2-diisocyanato-5,5-dimethyl-4,4-diphenyl-cyclohexane-1,3-dione

Systemtic Name: 2,2-diisocyanato-5,5-dimethyl-4,4-diphenyl-cyclohexane-1,3-dione Openeye Name: 2,2-diisocyanato-5,5-dimethyl-4,4-diphenyl-cyclohexane-1,3-dione CAS Name: 2,2-diisocyanato-5,5-dimethyl-4,4-diphenylcyclohexane-1,3-dione IUPAC Name: 2,2-diisocyanato-5,5-dimethyl-4,4-diphenylcyclohexane-1,3-dione Traditional Name: 2,2-diisocyanato-5,5-dimethyl-4,4-diphenyl-cyclohexane-1,3-quinone Formula: C22H18N2O4 MolecularWeight: 374.38932

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1(C2=CC=CC=C2)C3=CC=CC=C3)(N=C=O)N=C=O)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1(C2=CC=CC=C2)C3=CC=CC=C3)(N=C=O)N=C=O)C

InChI

InChI=1S/C22H18N2O4/c1-20(2)13-18(27)22(23-14-25,24-15-26)19(28)21(20,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12H,13H2,1-2H3