3-heptyl-2-oxidanyl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 3-heptyl-2-oxidanyl-cyclohepta-2,4,6-trien-1-one Openeye Name: 3-heptyl-2-hydroxy-cyclohepta-2,4,6-trien-1-one CAS Name: 3-heptyl-2-hydroxy-1-cyclohepta-2,4,6-trienone IUPAC Name: 3-heptyl-2-hydroxycyclohepta-2,4,6-trien-1-one Traditional Name: 3-heptyl-2-hydroxy-cyclohepta-2,4,6-trien-1-one Formula: C14H20O2 MolecularWeight: 220.3074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O2/c1-2-3-4-5-6-9-12-10-7-8-11-13(15)14(12)16/h7-8,10-11H,2-6,9H2,1H3,(H,15,16)