5-ethoxy-3-heptadecyl-2-oxidanyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 5-ethoxy-3-heptadecyl-2-oxidanyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 5-ethoxy-3-heptadecyl-2-hydroxy-1,4-benzoquinone CAS Name: 5-ethoxy-3-heptadecyl-2-hydroxycyclohexa-2,5-diene-1,4-dione IUPAC Name: 5-ethoxy-3-heptadecyl-2-hydroxycyclohexa-2,5-diene-1,4-dione Traditional Name: 5-ethoxy-3-heptadecyl-2-hydroxy-p-benzoquinone Formula: C25H42O4 MolecularWeight: 406.59858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=C(C(=O)C=C(C1=O)OCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=C(C(=O)C=C(C1=O)OCC)O

InChI

InChI=1S/C25H42O4/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/h20,27H,3-19H2,1-2H3