1-(4-hexylphenyl)-3-(4-oxidanylcyclohexa-1,5-dien-1-yl)propane-1,3-dione

Systemtic Name: 1-(4-hexylphenyl)-3-(4-oxidanylcyclohexa-1,5-dien-1-yl)propane-1,3-dione Openeye Name: 1-(4-hexylphenyl)-3-(4-hydroxycyclohexa-1,5-dien-1-yl)propane-1,3-dione CAS Name: 1-(4-hexylphenyl)-3-(4-hydroxy-1-cyclohexa-1,5-dienyl)propane-1,3-dione IUPAC Name: 1-(4-hexylphenyl)-3-(4-hydroxycyclohexa-1,5-dien-1-yl)propane-1,3-dione Traditional Name: 1-(4-hexylphenyl)-3-(4-hydroxycyclohexa-1,5-dien-1-yl)propane-1,3-dione Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)CC(=O)C2=CCC(C=C2)O

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)CC(=O)C2=CCC(C=C2)O

InChI

InChI=1S/C21H26O3/c1-2-3-4-5-6-16-7-9-17(10-8-16)20(23)15-21(24)18-11-13-19(22)14-12-18/h7-13,19,22H,2-6,14-15H2,1H3