5-ethoxy-3-[(E)-heptadec-10-enyl]-2-oxidanyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 5-ethoxy-3-[(E)-heptadec-10-enyl]-2-oxidanyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 5-ethoxy-3-[(E)-heptadec-10-enyl]-2-hydroxy-1,4-benzoquinone CAS Name: 5-ethoxy-3-[(E)-heptadec-10-enyl]-2-hydroxycyclohexa-2,5-diene-1,4-dione IUPAC Name: 5-ethoxy-3-[(E)-heptadec-10-enyl]-2-hydroxycyclohexa-2,5-diene-1,4-dione Traditional Name: 5-ethoxy-3-[(E)-heptadec-10-enyl]-2-hydroxy-p-benzoquinone Formula: C25H40O4 MolecularWeight: 404.5827

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CCCCCCCCCCC1=C(C(=O)C=C(C1=O)OCC)O

Isomeric SMILES

CCCCCC/C=C/CCCCCCCCCC1=C(C(=O)C=C(C1=O)OCC)O

InChI

InChI=1S/C25H40O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-24(27)22(26)20-23(25(21)28)29-4-2/h9-10,20,27H,3-8,11-19H2,1-2H3/b10-9+