[4-(4-chlorophenyl)-1-[4-(quinolin-2-ylmethoxy)phenyl]butyl] ethaneperoxoate

Systemtic Name: [4-(4-chlorophenyl)-1-[4-(quinolin-2-ylmethoxy)phenyl]butyl] ethaneperoxoate Openeye Name: [4-(4-chlorophenyl)-1-[4-(2-quinolylmethoxy)phenyl]butyl] peroxyacetate CAS Name: ethaneperoxoic acid [4-(4-chlorophenyl)-1-[4-(2-quinolinylmethoxy)phenyl]butyl] ester IUPAC Name: [4-(4-chlorophenyl)-1-[4-(quinolin-2-ylmethoxy)phenyl]butyl] ethaneperoxoate Traditional Name: peracetic acid [4-(4-chlorophenyl)-1-[4-(2-quinolylmethoxy)phenyl]butyl] ester Formula: C28H26ClNO4 MolecularWeight: 475.96334

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OOC(CCCC1=CC=C(C=C1)Cl)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(=O)OOC(CCCC1=CC=C(C=C1)Cl)C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C28H26ClNO4/c1-20(31)33-34-28(8-4-5-21-9-14-24(29)15-10-21)23-12-17-26(18-13-23)32-19-25-16-11-22-6-2-3-7-27(22)30-25/h2-3,6-7,9-18,28H,4-5,8,19H2,1H3