3-heptoxy-4-oxidanyl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-heptoxy-4-oxidanyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-heptoxy-4-hydroxy-cyclobut-3-ene-1,2-dione CAS Name: 3-heptoxy-4-hydroxycyclobut-3-ene-1,2-dione IUPAC Name: 3-heptoxy-4-hydroxycyclobut-3-ene-1,2-dione Traditional Name: 3-heptoxy-4-hydroxy-cyclobut-3-ene-1,2-quinone Formula: C11H16O4 MolecularWeight: 212.24234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C(=O)C1=O)O

Isomeric SMILES

CCCCCCCOC1=C(C(=O)C1=O)O

InChI

InChI=1S/C11H16O4/c1-2-3-4-5-6-7-15-11-9(13)8(12)10(11)14/h13H,2-7H2,1H3