4-(1-adamantyl)-1-phenyl-butane-1,3-dione

Systemtic Name: 4-(1-adamantyl)-1-phenyl-butane-1,3-dione Openeye Name: 4-(1-adamantyl)-1-phenyl-butane-1,3-dione CAS Name: 4-(1-adamantyl)-1-phenylbutane-1,3-dione IUPAC Name: 4-(1-adamantyl)-1-phenylbutane-1,3-dione Traditional Name: 4-(1-adamantyl)-1-phenyl-butane-1,3-dione Formula: C20H24O2 MolecularWeight: 296.40336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)CC(=O)C4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)CC(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H24O2/c21-18(9-19(22)17-4-2-1-3-5-17)13-20-10-14-6-15(11-20)8-16(7-14)12-20/h1-5,14-16H,6-13H2