5-(3-hydroxyphenyl)-2-(3-phenylpropanoyl)cyclohexane-1,3-dione

Systemtic Name: 5-(3-hydroxyphenyl)-2-(3-phenylpropanoyl)cyclohexane-1,3-dione Openeye Name: 5-(3-hydroxyphenyl)-2-(3-phenylpropanoyl)cyclohexane-1,3-dione CAS Name: 5-(3-hydroxyphenyl)-2-(1-oxo-3-phenylpropyl)cyclohexane-1,3-dione IUPAC Name: 5-(3-hydroxyphenyl)-2-(3-phenylpropanoyl)cyclohexane-1,3-dione Traditional Name: 2-hydrocinnamoyl-5-(3-hydroxyphenyl)cyclohexane-1,3-quinone Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C(C1=O)C(=O)CCC2=CC=CC=C2)C3=CC(=CC=C3)O

Isomeric SMILES

C1C(CC(=O)C(C1=O)C(=O)CCC2=CC=CC=C2)C3=CC(=CC=C3)O

InChI

InChI=1S/C21H20O4/c22-17-8-4-7-15(11-17)16-12-19(24)21(20(25)13-16)18(23)10-9-14-5-2-1-3-6-14/h1-8,11,16,21-22H,9-10,12-13H2