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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)SC3=C(C=CC=N3)C(=O)O

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)SC3=C(C=CC=N3)C(=O)O

InChI

InChI=1S/C15H13NO2S/c17-15(18)13-5-2-8-16-14(13)19-12-7-6-10-3-1-4-11(10)9-12/h2,5-9H,1,3-4H2,(H,17,18)