1-(4-heptyl-2-oxidanyl-phenyl)-2-oxidanyl-ethanone

Systemtic Name: 1-(4-heptyl-2-oxidanyl-phenyl)-2-oxidanyl-ethanone Openeye Name: 1-(4-heptyl-2-hydroxy-phenyl)-2-hydroxy-ethanone CAS Name: 1-(4-heptyl-2-hydroxyphenyl)-2-hydroxyethanone IUPAC Name: 1-(4-heptyl-2-hydroxyphenyl)-2-hydroxyethanone Traditional Name: 1-(4-heptyl-2-hydroxy-phenyl)-2-hydroxy-ethanone Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=C(C=C1)C(=O)CO)O

Isomeric SMILES

CCCCCCCC1=CC(=C(C=C1)C(=O)CO)O

InChI

InChI=1S/C15H22O3/c1-2-3-4-5-6-7-12-8-9-13(14(17)10-12)15(18)11-16/h8-10,16-17H,2-7,11H2,1H3