3,3-diisocyanato-1,6-dimethyl-6-phenyl-cyclohexa-1,4-diene

Systemtic Name: 3,3-diisocyanato-1,6-dimethyl-6-phenyl-cyclohexa-1,4-diene Openeye Name: 3,3-diisocyanato-1,6-dimethyl-6-phenyl-cyclohexa-1,4-diene CAS Name: 3,3-diisocyanato-1,6-dimethyl-6-phenylcyclohexa-1,4-diene IUPAC Name: 3,3-diisocyanato-1,6-dimethyl-6-phenylcyclohexa-1,4-diene Traditional Name: 3,3-diisocyanato-1,6-dimethyl-6-phenyl-cyclohexa-1,4-diene Formula: C16H14N2O2 MolecularWeight: 266.29456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O2/c1-13-10-16(17-11-19,18-12-20)9-8-15(13,2)14-6-4-3-5-7-14/h3-10H,1-2H3