1,3-bis(1-adamantyl)-2-phenyl-propane-1,3-dione

Systemtic Name: 1,3-bis(1-adamantyl)-2-phenyl-propane-1,3-dione Openeye Name: 1,3-bis(1-adamantyl)-2-phenyl-propane-1,3-dione CAS Name: 1,3-bis(1-adamantyl)-2-phenylpropane-1,3-dione IUPAC Name: 1,3-bis(1-adamantyl)-2-phenylpropane-1,3-dione Traditional Name: 1,3-bis(1-adamantyl)-2-phenyl-propane-1,3-dione Formula: C29H36O2 MolecularWeight: 416.59494

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)C(C4=CC=CC=C4)C(=O)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)C(C4=CC=CC=C4)C(=O)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C29H36O2/c30-26(28-12-18-6-19(13-28)8-20(7-18)14-28)25(24-4-2-1-3-5-24)27(31)29-15-21-9-22(16-29)11-23(10-21)17-29/h1-5,18-23,25H,6-17H2