5-(2,3-dicyclohexyl-3-oxidanylidene-1-phenyl-propyl)-2,2-dimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-(2,3-dicyclohexyl-3-oxidanylidene-1-phenyl-propyl)-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-(2,3-dicyclohexyl-3-oxo-1-phenyl-propyl)-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-(2,3-dicyclohexyl-3-oxo-1-phenylpropyl)-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-(2,3-dicyclohexyl-3-oxo-1-phenylpropyl)-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-(2,3-dicyclohexyl-3-keto-1-phenyl-propyl)-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C27H36O5 MolecularWeight: 440.57174

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)C(C2=CC=CC=C2)C(C3CCCCC3)C(=O)C4CCCCC4)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)C(C2=CC=CC=C2)C(C3CCCCC3)C(=O)C4CCCCC4)C

InChI

InChI=1S/C27H36O5/c1-27(2)31-25(29)23(26(30)32-27)21(18-12-6-3-7-13-18)22(19-14-8-4-9-15-19)24(28)20-16-10-5-11-17-20/h3,6-7,12-13,19-23H,4-5,8-11,14-17H2,1-2H3