1-methoxy-3-(oxidanylsulfanylmethyl)benzene; 3-methoxy-8-thiabicyclo[2.2.2]octa-1,3,5-triene

Systemtic Name: 1-methoxy-3-(oxidanylsulfanylmethyl)benzene; 3-methoxy-8-thiabicyclo[2.2.2]octa-1,3,5-triene Openeye Name: 1-(hydroxysulfanylmethyl)-3-methoxy-benzene; 3-methoxy-8-thiabicyclo[2.2.2]octa-1,3,5-triene CAS Name: (3-methoxyphenyl)methanesulfenic acid; 3-methoxy-8-thiabicyclo[2.2.2]octa-1,3,5-triene IUPAC Name: 1-(hydroxysulfanylmethyl)-3-methoxybenzene; 3-methoxy-8-thiabicyclo[2.2.2]octa-1,3,5-triene Traditional Name: 1-methoxy-3-(sulfenomethyl)benzene; 3-methoxy-8-thiabicyclo[2.2.2]octa-1,3,5-triene Formula: C16H18O3S2 MolecularWeight: 322.44232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSO.COC1=C2C=CC(=C1)CS2

Isomeric SMILES

COC1=CC=CC(=C1)CSO.COC1=C2C=CC(=C1)CS2

InChI

InChI=1S/C8H10O2S.C8H8OS/c1-10-8-4-2-3-7(5-8)6-11-9;1-9-7-4-6-2-3-8(7)10-5-6/h2-5,9H,6H2,1H3;2-4H,5H2,1H3