2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[2-(1H-imidazol-5-yl)ethyliminomethyl]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C14H19N3O2 MolecularWeight: 261.31956

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C=NCCC2=CN=CN2)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C=NCCC2=CN=CN2)C

InChI

InChI=1S/C14H19N3O2/c1-14(2)5-12(18)11(13(19)6-14)8-15-4-3-10-7-16-9-17-10/h7-9,11H,3-6H2,1-2H3,(H,16,17)