5-(4-phenoxyphenyl)cyclohexane-1,3-dione

Systemtic Name: 5-(4-phenoxyphenyl)cyclohexane-1,3-dione Openeye Name: 5-(4-phenoxyphenyl)cyclohexane-1,3-dione CAS Name: 5-(4-phenoxyphenyl)cyclohexane-1,3-dione IUPAC Name: 5-(4-phenoxyphenyl)cyclohexane-1,3-dione Traditional Name: 5-(4-phenoxyphenyl)cyclohexane-1,3-quinone Formula: C18H16O3 MolecularWeight: 280.31784

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)CC1=O)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C1C(CC(=O)CC1=O)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C18H16O3/c19-15-10-14(11-16(20)12-15)13-6-8-18(9-7-13)21-17-4-2-1-3-5-17/h1-9,14H,10-12H2