2-[[5,6-bis(chloranyl)indol-1-yl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[5,6-bis(chloranyl)indol-1-yl]methylsulfanyl]ethanoic acid Openeye Name: 2-[(5,6-dichloroindol-1-yl)methylsulfanyl]acetic acid CAS Name: 2-[(5,6-dichloro-1-indolyl)methylthio]acetic acid IUPAC Name: 2-[(5,6-dichloroindol-1-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(5,6-dichloroindol-1-yl)methylthio]acetic acid Formula: C11H9Cl2NO2S MolecularWeight: 290.16566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C2=CC(=C(C=C21)Cl)Cl)CSCC(=O)O

Isomeric SMILES

C1=CN(C2=CC(=C(C=C21)Cl)Cl)CSCC(=O)O

InChI

InChI=1S/C11H9Cl2NO2S/c12-8-3-7-1-2-14(6-17-5-11(15)16)10(7)4-9(8)13/h1-4H,5-6H2,(H,15,16)