2-piperidin-1-ium-4-ylsulfanylquinoline

Systemtic Name: 2-piperidin-1-ium-4-ylsulfanylquinoline Openeye Name: 2-piperidin-1-ium-4-ylsulfanylquinoline CAS Name: 2-(4-piperidin-1-iumylthio)quinoline IUPAC Name: 2-piperidin-1-ium-4-ylsulfanylquinoline Traditional Name: 2-(piperidin-1-ium-4-ylthio)quinoline Formula: C14H17N2S+ MolecularWeight: 245.36318

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1SC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

C1C[NH2+]CCC1SC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C14H16N2S/c1-2-4-13-11(3-1)5-6-14(16-13)17-12-7-9-15-10-8-12/h1-6,12,15H,7-10H2/p+1