4-(2,3-dihydro-1H-inden-5-ylsulfanyl)pyridine-2-carboxylic acid

Systemtic Name: 4-(2,3-dihydro-1H-inden-5-ylsulfanyl)pyridine-2-carboxylic acid Openeye Name: 4-indan-5-ylsulfanylpyridine-2-carboxylic acid CAS Name: 4-(2,3-dihydro-1H-inden-5-ylthio)-2-pyridinecarboxylic acid IUPAC Name: 4-(2,3-dihydro-1H-inden-5-ylsulfanyl)pyridine-2-carboxylic acid Traditional Name: 4-(indan-5-ylthio)picolinic acid Formula: C15H13NO2S MolecularWeight: 271.33422

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)SC3=CC(=NC=C3)C(=O)O

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)SC3=CC(=NC=C3)C(=O)O

InChI

InChI=1S/C15H13NO2S/c17-15(18)14-9-13(6-7-16-14)19-12-5-4-10-2-1-3-11(10)8-12/h4-9H,1-3H2,(H,17,18)