1-[(4-fluorophenyl)methyl]-5-methylperoxysulfanyl-2-(oxan-4-yl)indole

Systemtic Name: 1-[(4-fluorophenyl)methyl]-5-methylperoxysulfanyl-2-(oxan-4-yl)indole Openeye Name: 1-[(4-fluorophenyl)methyl]-5-methylperoxysulfanyl-2-tetrahydropyran-4-yl-indole CAS Name: 1-[(4-fluorophenyl)methyl]-2-(4-oxanyl)-5-indolesulfenic acid methoxy ester IUPAC Name: 1-[(4-fluorophenyl)methyl]-5-methylperoxysulfanyl-2-(oxan-4-yl)indole Traditional Name: 1-(4-fluorobenzyl)-5-(methylperoxythio)-2-tetrahydropyran-4-yl-indole Formula: C21H22FNO3S MolecularWeight: 387.467683

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Descriptors Computed from Structure

Canonical SMILES:

COOSC1=CC2=C(C=C1)N(C(=C2)C3CCOCC3)CC4=CC=C(C=C4)F

Isomeric SMILES

COOSC1=CC2=C(C=C1)N(C(=C2)C3CCOCC3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FNO3S/c1-24-26-27-19-6-7-20-17(12-19)13-21(16-8-10-25-11-9-16)23(20)14-15-2-4-18(22)5-3-15/h2-7,12-13,16H,8-11,14H2,1H3