1-[4-(3-hydroxyphenyl)-1-oxidanyl-cyclohexa-2,5-dien-1-yl]-2-methyl-butan-1-one

Systemtic Name: 1-[4-(3-hydroxyphenyl)-1-oxidanyl-cyclohexa-2,5-dien-1-yl]-2-methyl-butan-1-one Openeye Name: 1-[1-hydroxy-4-(3-hydroxyphenyl)cyclohexa-2,5-dien-1-yl]-2-methyl-butan-1-one CAS Name: 1-[1-hydroxy-4-(3-hydroxyphenyl)-1-cyclohexa-2,5-dienyl]-2-methyl-1-butanone IUPAC Name: 1-[1-hydroxy-4-(3-hydroxyphenyl)cyclohexa-2,5-dien-1-yl]-2-methylbutan-1-one Traditional Name: 1-[1-hydroxy-4-(3-hydroxyphenyl)cyclohexa-2,5-dien-1-yl]-2-methyl-butan-1-one Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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