2-[7-methyl-3-methylidene-6,7-bis(oxidanyl)oct-1-ynyl]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-[7-methyl-3-methylidene-6,7-bis(oxidanyl)oct-1-ynyl]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-(6,7-dihydroxy-7-methyl-3-methylene-oct-1-ynyl)-1,4-benzoquinone CAS Name: 2-(6,7-dihydroxy-7-methyl-3-methyleneoct-1-ynyl)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-(6,7-dihydroxy-7-methyl-3-methylideneoct-1-ynyl)cyclohexa-2,5-diene-1,4-dione Traditional Name: 2-[3-(3,4-dihydroxy-4-methyl-pentyl)but-3-en-1-ynyl]-p-benzoquinone Formula: C16H18O4 MolecularWeight: 274.31172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(CCC(=C)C#CC1=CC(=O)C=CC1=O)O)O

Isomeric SMILES

CC(C)(C(CCC(=C)C#CC1=CC(=O)C=CC1=O)O)O

InChI

InChI=1S/C16H18O4/c1-11(5-9-15(19)16(2,3)20)4-6-12-10-13(17)7-8-14(12)18/h7-8,10,15,19-20H,1,5,9H2,2-3H3