1-(4-methoxyphenyl)-1-sulfonyl-heptane-3-thiol

Systemtic Name: 1-(4-methoxyphenyl)-1-sulfonyl-heptane-3-thiol Openeye Name: 1-(4-methoxyphenyl)-1-sulfonyl-heptane-3-thiol CAS Name: 1-(4-methoxyphenyl)-1-sulfonyl-3-heptanethiol IUPAC Name: 1-(4-methoxyphenyl)-1-sulfonylheptane-3-thiol Traditional Name: 1-(4-methoxyphenyl)-1-sulfonyl-heptane-3-thiol Formula: C14H20O3S2 MolecularWeight: 300.4368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=S(=O)=O)C1=CC=C(C=C1)OC)S

Isomeric SMILES

CCCCC(CC(=S(=O)=O)C1=CC=C(C=C1)OC)S

InChI

InChI=1S/C14H20O3S2/c1-3-4-5-13(18)10-14(19(15)16)11-6-8-12(17-2)9-7-11/h6-9,13,18H,3-5,10H2,1-2H3