3-oxidanyl-1-(4-oxidanyl-3-propyl-phenyl)butan-1-one

Systemtic Name: 3-oxidanyl-1-(4-oxidanyl-3-propyl-phenyl)butan-1-one Openeye Name: 3-hydroxy-1-(4-hydroxy-3-propyl-phenyl)butan-1-one CAS Name: 3-hydroxy-1-(4-hydroxy-3-propylphenyl)-1-butanone IUPAC Name: 3-hydroxy-1-(4-hydroxy-3-propylphenyl)butan-1-one Traditional Name: 3-hydroxy-1-(4-hydroxy-3-propyl-phenyl)butan-1-one Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C(=O)CC(C)O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)C(=O)CC(C)O)O

InChI

InChI=1S/C13H18O3/c1-3-4-10-8-11(5-6-12(10)15)13(16)7-9(2)14/h5-6,8-9,14-15H,3-4,7H2,1-2H3