5,5-dimethyl-2-[(2-methylpropylamino)methylidene]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[(2-methylpropylamino)methylidene]cyclohexane-1,3-dione Openeye Name: 2-[(isobutylamino)methylene]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[(2-methylpropylamino)methylidene]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[(2-methylpropylamino)methylidene]cyclohexane-1,3-dione Traditional Name: 2-[(isobutylamino)methylene]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C13H21NO2 MolecularWeight: 223.31134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC=C1C(=O)CC(CC1=O)(C)C

Isomeric SMILES

CC(C)CNC=C1C(=O)CC(CC1=O)(C)C

InChI

InChI=1S/C13H21NO2/c1-9(2)7-14-8-10-11(15)5-13(3,4)6-12(10)16/h8-9,14H,5-7H2,1-4H3