5-(4-methylthiophen-2-yl)-2-(1-oxidanylbutylidene)cyclohexane-1,3-dione

Systemtic Name: 5-(4-methylthiophen-2-yl)-2-(1-oxidanylbutylidene)cyclohexane-1,3-dione Openeye Name: 2-(1-hydroxybutylidene)-5-(4-methyl-2-thienyl)cyclohexane-1,3-dione CAS Name: 2-(1-hydroxybutylidene)-5-(4-methyl-2-thiophenyl)cyclohexane-1,3-dione IUPAC Name: 2-(1-hydroxybutylidene)-5-(4-methylthiophen-2-yl)cyclohexane-1,3-dione Traditional Name: 2-(1-hydroxybutylidene)-5-(4-methyl-2-thienyl)cyclohexane-1,3-quinone Formula: C15H18O3S MolecularWeight: 278.36662

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C(=O)CC(CC1=O)C2=CC(=CS2)C)O

Isomeric SMILES

CCCC(=C1C(=O)CC(CC1=O)C2=CC(=CS2)C)O

InChI

InChI=1S/C15H18O3S/c1-3-4-11(16)15-12(17)6-10(7-13(15)18)14-5-9(2)8-19-14/h5,8,10,16H,3-4,6-7H2,1-2H3