(E)-3-(5-fluoranyl-1H-indol-3-yl)-2-sulfanyl-prop-2-enoic acid

Systemtic Name: (E)-3-(5-fluoranyl-1H-indol-3-yl)-2-sulfanyl-prop-2-enoic acid Openeye Name: (E)-3-(5-fluoro-1H-indol-3-yl)-2-sulfanyl-prop-2-enoic acid CAS Name: (E)-3-(5-fluoro-1H-indol-3-yl)-2-mercapto-2-propenoic acid IUPAC Name: (E)-3-(5-fluoro-1H-indol-3-yl)-2-sulfanylprop-2-enoic acid Traditional Name: (E)-3-(5-fluoro-1H-indol-3-yl)-2-mercapto-acrylic acid Formula: C11H8FNO2S MolecularWeight: 237.250123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1F)C(=CN2)C=C(C(=O)O)S

Isomeric SMILES

C1=CC2=C(C=C1F)C(=CN2)/C=C(\C(=O)O)/S

InChI

InChI=1S/C11H8FNO2S/c12-7-1-2-9-8(4-7)6(5-13-9)3-10(16)11(14)15/h1-5,13,16H,(H,14,15)/b10-3+