2-[(5-chloranylindol-1-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(5-chloranylindol-1-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(5-chloroindol-1-yl)methylsulfanyl]acetic acid CAS Name: 2-[(5-chloro-1-indolyl)methylthio]acetic acid IUPAC Name: 2-[(5-chloroindol-1-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(5-chloroindol-1-yl)methylthio]acetic acid Formula: C11H10ClNO2S MolecularWeight: 255.7206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN2CSCC(=O)O)C=C1Cl

Isomeric SMILES

C1=CC2=C(C=CN2CSCC(=O)O)C=C1Cl

InChI

InChI=1S/C11H10ClNO2S/c12-9-1-2-10-8(5-9)3-4-13(10)7-16-6-11(14)15/h1-5H,6-7H2,(H,14,15)