(3-propan-2-ylphenyl) 2-[(2-chlorophenyl)-(1,3-oxazol-4-yl)methyl]-2-methyl-3-oxidanyl-pentaneperoxoate

Systemtic Name: (3-propan-2-ylphenyl) 2-[(2-chlorophenyl)-(1,3-oxazol-4-yl)methyl]-2-methyl-3-oxidanyl-pentaneperoxoate Openeye Name: (3-isopropylphenyl) 2-[(2-chlorophenyl)-oxazol-4-yl-methyl]-3-hydroxy-2-methyl-pentaneperoxoate CAS Name: 2-[(2-chlorophenyl)-(4-oxazolyl)methyl]-3-hydroxy-2-methylpentaneperoxoic acid (3-propan-2-ylphenyl) ester IUPAC Name: (3-propan-2-ylphenyl) 2-[(2-chlorophenyl)-(1,3-oxazol-4-yl)methyl]-3-hydroxy-2-methylpentaneperoxoate Traditional Name: 2-[(2-chlorophenyl)-oxazol-4-yl-methyl]-3-hydroxy-2-methyl-peroxyvaleric acid m-cumenyl ester Formula: C25H28ClNO5 MolecularWeight: 457.94652

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)(C(C1=CC=CC=C1Cl)C2=COC=N2)C(=O)OOC3=CC=CC(=C3)C(C)C)O

Isomeric SMILES

CCC(C(C)(C(C1=CC=CC=C1Cl)C2=COC=N2)C(=O)OOC3=CC=CC(=C3)C(C)C)O

InChI

InChI=1S/C25H28ClNO5/c1-5-22(28)25(4,24(29)32-31-18-10-8-9-17(13-18)16(2)3)23(21-14-30-15-27-21)19-11-6-7-12-20(19)26/h6-16,22-23,28H,5H2,1-4H3