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

Systemtic Name: 2-(1-oxidanylbutylidene)-5-(1,3-thiazol-2-yl)cyclohexane-1,3-dione Openeye Name: 2-(1-hydroxybutylidene)-5-thiazol-2-yl-cyclohexane-1,3-dione CAS Name: 2-(1-hydroxybutylidene)-5-(2-thiazolyl)cyclohexane-1,3-dione IUPAC Name: 2-(1-hydroxybutylidene)-5-(1,3-thiazol-2-yl)cyclohexane-1,3-dione Traditional Name: 2-(1-hydroxybutylidene)-5-thiazol-2-yl-cyclohexane-1,3-quinone Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO3S/c1-2-3-9(15)12-10(16)6-8(7-11(12)17)13-14-4-5-18-13/h4-5,8,15H,2-3,6-7H2,1H3