5,5-dimethyl-2-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]cyclohexane-1,3-dione Openeye Name: 2-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]cyclohexane-1,3-dione IUPAC Name: 2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[2-(4-benzylpiperidino)-2-keto-ethyl]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)CC(=O)N2CCC(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)CC(=O)N2CCC(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H29NO3/c1-22(2)14-19(24)18(20(25)15-22)13-21(26)23-10-8-17(9-11-23)12-16-6-4-3-5-7-16/h3-7,17-18H,8-15H2,1-2H3