3-[2-(1H-imidazol-5-yl)ethylamino]-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 3-[2-(1H-imidazol-5-yl)ethylamino]-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 3-[2-(1H-imidazol-5-yl)ethylamino]-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-[2-(1H-imidazol-5-yl)ethylamino]-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-[2-(1H-imidazol-5-yl)ethylamino]-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-[2-(1H-imidazol-5-yl)ethylamino]-5,5-dimethyl-cyclohex-2-en-1-one Formula: C13H19N3O MolecularWeight: 233.30946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O/c1-13(2)6-11(5-12(17)7-13)15-4-3-10-8-14-9-16-10/h5,8-9,15H,3-4,6-7H2,1-2H3,(H,14,16)