5-(3-butan-2-yl-5-methyl-4H-1,2-oxazol-5-yl)-2-(1-oxidanylbutylidene)cyclohexane-1,3-dione

Systemtic Name: 5-(3-butan-2-yl-5-methyl-4H-1,2-oxazol-5-yl)-2-(1-oxidanylbutylidene)cyclohexane-1,3-dione Openeye Name: 2-(1-hydroxybutylidene)-5-(5-methyl-3-sec-butyl-4H-isoxazol-5-yl)cyclohexane-1,3-dione CAS Name: 5-(3-butan-2-yl-5-methyl-4H-isoxazol-5-yl)-2-(1-hydroxybutylidene)cyclohexane-1,3-dione IUPAC Name: 5-(3-butan-2-yl-5-methyl-4H-1,2-oxazol-5-yl)-2-(1-hydroxybutylidene)cyclohexane-1,3-dione Traditional Name: 2-(1-hydroxybutylidene)-5-(5-methyl-3-sec-butyl-2-isoxazolin-5-yl)cyclohexane-1,3-quinone Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO4/c1-5-7-14(20)17-15(21)8-12(9-16(17)22)18(4)10-13(19-23-18)11(3)6-2/h11-12,20H,5-10H2,1-4H3