2-methyl-5-[(E)-nonadec-14-enyl]-3,6-bis(oxidanyl)cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-methyl-5-[(E)-nonadec-14-enyl]-3,6-bis(oxidanyl)cyclohexa-2,5-diene-1,4-dione Openeye Name: 2,5-dihydroxy-3-methyl-6-[(E)-nonadec-14-enyl]-1,4-benzoquinone CAS Name: 2,5-dihydroxy-3-methyl-6-[(E)-nonadec-14-enyl]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2,5-dihydroxy-3-methyl-6-[(E)-nonadec-14-enyl]cyclohexa-2,5-diene-1,4-dione Traditional Name: 2,5-dihydroxy-3-methyl-6-[(E)-nonadec-14-enyl]-p-benzoquinone Formula: C26H42O4 MolecularWeight: 418.60928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CCCCCCCCCCCCCCC1=C(C(=O)C(=C(C1=O)O)C)O

Isomeric SMILES

CCCC/C=C/CCCCCCCCCCCCCC1=C(C(=O)C(=C(C1=O)O)C)O

InChI

InChI=1S/C26H42O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-25(29)23(27)21(2)24(28)26(22)30/h6-7,27,30H,3-5,8-20H2,1-2H3/b7-6+