[4-(4-phenylphenyl)carbothioylphenyl] 3-oxidanylhexaneperoxoate

Systemtic Name: [4-(4-phenylphenyl)carbothioylphenyl] 3-oxidanylhexaneperoxoate Openeye Name: [4-(4-phenylbenzenecarbothioyl)phenyl] 3-hydroxyhexaneperoxoate CAS Name: 3-hydroxyhexaneperoxoic acid [4-[(4-phenylphenyl)-sulfanylidenemethyl]phenyl] ester IUPAC Name: [4-(4-phenylbenzenecarbothioyl)phenyl] 3-hydroxyhexaneperoxoate Traditional Name: 3-hydroxyhexaneperoxoic acid [4-(4-phenylthiobenzoyl)phenyl] ester Formula: C25H24O4S MolecularWeight: 420.52066

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(=O)OOC1=CC=C(C=C1)C(=S)C2=CC=C(C=C2)C3=CC=CC=C3)O

Isomeric SMILES

CCCC(CC(=O)OOC1=CC=C(C=C1)C(=S)C2=CC=C(C=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C25H24O4S/c1-2-6-22(26)17-24(27)29-28-23-15-13-21(14-16-23)25(30)20-11-9-19(10-12-20)18-7-4-3-5-8-18/h3-5,7-16,22,26H,2,6,17H2,1H3