2-[3,4-bis(chloranyl)-5-methoxy-phenyl]ethanethiol

Systemtic Name: 2-[3,4-bis(chloranyl)-5-methoxy-phenyl]ethanethiol Openeye Name: 2-(3,4-dichloro-5-methoxy-phenyl)ethanethiol CAS Name: 2-(3,4-dichloro-5-methoxyphenyl)ethanethiol IUPAC Name: 2-(3,4-dichloro-5-methoxyphenyl)ethanethiol Traditional Name: 2-(3,4-dichloro-5-methoxy-phenyl)ethanethiol Formula: C9H10Cl2OS MolecularWeight: 237.1461

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CCS)Cl)Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)CCS)Cl)Cl

InChI

InChI=1S/C9H10Cl2OS/c1-12-8-5-6(2-3-13)4-7(10)9(8)11/h4-5,13H,2-3H2,1H3