3,5,5-trimethyl-4-[(1E,3Z)-3-methyl-5-oxidanylidene-5-(4-pyrimidin-2-ylpiperazin-1-yl)penta-1,3-dienyl]-4-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 3,5,5-trimethyl-4-[(1E,3Z)-3-methyl-5-oxidanylidene-5-(4-pyrimidin-2-ylpiperazin-1-yl)penta-1,3-dienyl]-4-oxidanyl-cyclohex-2-en-1-one Openeye Name: 4-hydroxy-3,5,5-trimethyl-4-[(1E,3Z)-3-methyl-5-oxo-5-(4-pyrimidin-2-ylpiperazin-1-yl)penta-1,3-dienyl]cyclohex-2-en-1-one CAS Name: 4-hydroxy-3,5,5-trimethyl-4-[(1E,3Z)-3-methyl-5-oxo-5-[4-(2-pyrimidinyl)-1-piperazinyl]penta-1,3-dienyl]-1-cyclohex-2-enone IUPAC Name: 4-hydroxy-3,5,5-trimethyl-4-[(1E,3Z)-3-methyl-5-oxo-5-(4-pyrimidin-2-ylpiperazin-1-yl)penta-1,3-dienyl]cyclohex-2-en-1-one Traditional Name: 4-hydroxy-4-[(1E,3Z)-5-keto-3-methyl-5-[4-(2-pyrimidyl)piperazino]penta-1,3-dienyl]-3,5,5-trimethyl-cyclohex-2-en-1-one Formula: C23H30N4O3 MolecularWeight: 410.5093

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)CC(C1(C=CC(=CC(=O)N2CCN(CC2)C3=NC=CC=N3)C)O)(C)C

Isomeric SMILES

CC1=CC(=O)CC(C1(/C=C/C(=C\C(=O)N2CCN(CC2)C3=NC=CC=N3)/C)O)(C)C

InChI

InChI=1S/C23H30N4O3/c1-17(6-7-23(30)18(2)15-19(28)16-22(23,3)4)14-20(29)26-10-12-27(13-11-26)21-24-8-5-9-25-21/h5-9,14-15,30H,10-13,16H2,1-4H3/b7-6+,17-14-