2-(3-chloranylpropyl)-2-(3,4-dimethoxyphenyl)-1,3-dithiane

Systemtic Name: 2-(3-chloranylpropyl)-2-(3,4-dimethoxyphenyl)-1,3-dithiane Openeye Name: 2-(3-chloropropyl)-2-(3,4-dimethoxyphenyl)-1,3-dithiane CAS Name: 2-(3-chloropropyl)-2-(3,4-dimethoxyphenyl)-1,3-dithiane IUPAC Name: 2-(3-chloropropyl)-2-(3,4-dimethoxyphenyl)-1,3-dithiane Traditional Name: 2-(3-chloropropyl)-2-(3,4-dimethoxyphenyl)-1,3-dithiane Formula: C15H21ClO2S2 MolecularWeight: 332.90904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(SCCCS2)CCCCl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2(SCCCS2)CCCCl)OC

InChI

InChI=1S/C15H21ClO2S2/c1-17-13-6-5-12(11-14(13)18-2)15(7-3-8-16)19-9-4-10-20-15/h5-6,11H,3-4,7-10H2,1-2H3