(2-methylphenyl)carbonyl 4-oxidanyl-2-propyl-benzenecarboperoxoate

Systemtic Name: (2-methylphenyl)carbonyl 4-oxidanyl-2-propyl-benzenecarboperoxoate Openeye Name: (2-methylbenzoyl) 4-hydroxy-2-propyl-benzenecarboperoxoate CAS Name: 4-hydroxy-2-propylbenzenecarboperoxoic acid [(2-methylphenyl)-oxomethyl] ester IUPAC Name: (2-methylbenzoyl) 4-hydroxy-2-propylbenzenecarboperoxoate Traditional Name: 4-hydroxy-2-propyl-benzenecarboperoxoic acid o-toluoyl ester Formula: C18H18O5 MolecularWeight: 314.33252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)O)C(=O)OOC(=O)C2=CC=CC=C2C

Isomeric SMILES

CCCC1=C(C=CC(=C1)O)C(=O)OOC(=O)C2=CC=CC=C2C

InChI

InChI=1S/C18H18O5/c1-3-6-13-11-14(19)9-10-16(13)18(21)23-22-17(20)15-8-5-4-7-12(15)2/h4-5,7-11,19H,3,6H2,1-2H3