2-(1-oxidanylbutylidene)-5-[3-(oxolan-2-yl)-1,2-oxazol-5-yl]cyclohexane-1,3-dione

Systemtic Name: 2-(1-oxidanylbutylidene)-5-[3-(oxolan-2-yl)-1,2-oxazol-5-yl]cyclohexane-1,3-dione Openeye Name: 2-(1-hydroxybutylidene)-5-(3-tetrahydrofuran-2-ylisoxazol-5-yl)cyclohexane-1,3-dione CAS Name: 2-(1-hydroxybutylidene)-5-[3-(2-oxolanyl)-5-isoxazolyl]cyclohexane-1,3-dione IUPAC Name: 2-(1-hydroxybutylidene)-5-[3-(oxolan-2-yl)-1,2-oxazol-5-yl]cyclohexane-1,3-dione Traditional Name: 2-(1-hydroxybutylidene)-5-[3-(tetrahydrofuryl)isoxazol-5-yl]cyclohexane-1,3-quinone Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C(=O)CC(CC1=O)C2=CC(=NO2)C3CCCO3)O

Isomeric SMILES

CCCC(=C1C(=O)CC(CC1=O)C2=CC(=NO2)C3CCCO3)O

InChI

InChI=1S/C17H21NO5/c1-2-4-12(19)17-13(20)7-10(8-14(17)21)16-9-11(18-23-16)15-5-3-6-22-15/h9-10,15,19H,2-8H2,1H3