[2-methyl-6-[[3-methyl-5-(quinolin-2-ylmethoxy)phenoxy]methyl]phenyl] ethaneperoxoate

Systemtic Name: [2-methyl-6-[[3-methyl-5-(quinolin-2-ylmethoxy)phenoxy]methyl]phenyl] ethaneperoxoate Openeye Name: [2-methyl-6-[[3-methyl-5-(2-quinolylmethoxy)phenoxy]methyl]phenyl] peroxyacetate CAS Name: ethaneperoxoic acid [2-methyl-6-[[3-methyl-5-(2-quinolinylmethoxy)phenoxy]methyl]phenyl] ester IUPAC Name: [2-methyl-6-[[3-methyl-5-(quinolin-2-ylmethoxy)phenoxy]methyl]phenyl] ethaneperoxoate Traditional Name: peracetic acid [2-methyl-6-[[3-methyl-5-(2-quinolylmethoxy)phenoxy]methyl]phenyl] ester Formula: C27H25NO5 MolecularWeight: 443.4911

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COC2=CC(=CC(=C2)C)OCC3=NC4=CC=CC=C4C=C3)OOC(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)COC2=CC(=CC(=C2)C)OCC3=NC4=CC=CC=C4C=C3)OOC(=O)C

InChI

InChI=1S/C27H25NO5/c1-18-13-24(30-16-22-9-6-7-19(2)27(22)33-32-20(3)29)15-25(14-18)31-17-23-12-11-21-8-4-5-10-26(21)28-23/h4-15H,16-17H2,1-3H3