2,5,5-trimethyl-2-phenacyl-cyclohexane-1,3-dione

Systemtic Name: 2,5,5-trimethyl-2-phenacyl-cyclohexane-1,3-dione Openeye Name: 2,5,5-trimethyl-2-phenacyl-cyclohexane-1,3-dione CAS Name: 2,5,5-trimethyl-2-phenacylcyclohexane-1,3-dione IUPAC Name: 2,5,5-trimethyl-2-phenacylcyclohexane-1,3-dione Traditional Name: 2,5,5-trimethyl-2-phenacyl-cyclohexane-1,3-quinone Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)(C)CC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)(C)CC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C17H20O3/c1-16(2)10-14(19)17(3,15(20)11-16)9-13(18)12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3