4-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]-2-oxidanylidene-pentyl]-N-oxidanyl-benzamide

Systemtic Name: 4-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]-2-oxidanylidene-pentyl]-N-oxidanyl-benzamide Openeye Name: 4-[3-[2,4-bis(1,1-dimethylpropyl)phenoxy]-2-oxo-pentyl]benzenecarbohydroxamic acid CAS Name: 4-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]-2-oxopentyl]-N-hydroxybenzamide IUPAC Name: 4-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]-2-oxopentyl]-N-hydroxybenzamide Traditional Name: 4-[3-(2,4-ditert-amylphenoxy)-2-keto-pentyl]benzenecarbohydroxamic acid Formula: C28H39NO4 MolecularWeight: 453.61356

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)CC1=CC=C(C=C1)C(=O)NO)OC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCC(C(=O)CC1=CC=C(C=C1)C(=O)NO)OC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C28H39NO4/c1-8-24(23(30)17-19-11-13-20(14-12-19)26(31)29-32)33-25-16-15-21(27(4,5)9-2)18-22(25)28(6,7)10-3/h11-16,18,24,32H,8-10,17H2,1-7H3,(H,29,31)