2-[(4-oxidanylindol-1-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(4-oxidanylindol-1-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(4-hydroxyindol-1-yl)methylsulfanyl]acetic acid CAS Name: 2-[(4-hydroxy-1-indolyl)methylthio]acetic acid IUPAC Name: 2-[(4-hydroxyindol-1-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(4-hydroxyindol-1-yl)methylthio]acetic acid Formula: C11H11NO3S MolecularWeight: 237.27494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO3S/c13-10-3-1-2-9-8(10)4-5-12(9)7-16-6-11(14)15/h1-5,13H,6-7H2,(H,14,15)