3-ethyl-6,7-dimethoxy-2-(2-piperidin-1-ium-1-ylethylsulfanyl)quinoline

Systemtic Name: 3-ethyl-6,7-dimethoxy-2-(2-piperidin-1-ium-1-ylethylsulfanyl)quinoline Openeye Name: 3-ethyl-6,7-dimethoxy-2-(2-piperidin-1-ium-1-ylethylsulfanyl)quinoline CAS Name: 3-ethyl-6,7-dimethoxy-2-[2-(1-piperidin-1-iumyl)ethylthio]quinoline IUPAC Name: 3-ethyl-6,7-dimethoxy-2-(2-piperidin-1-ium-1-ylethylsulfanyl)quinoline Traditional Name: 3-ethyl-6,7-dimethoxy-2-(2-piperidin-1-ium-1-ylethylthio)quinoline Formula: C20H29N2O2S+ MolecularWeight: 361.52146

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=C(C(=CC2=C1)OC)OC)SCC[NH+]3CCCCC3

Isomeric SMILES

CCC1=C(N=C2C=C(C(=CC2=C1)OC)OC)SCC[NH+]3CCCCC3

InChI

InChI=1S/C20H28N2O2S/c1-4-15-12-16-13-18(23-2)19(24-3)14-17(16)21-20(15)25-11-10-22-8-6-5-7-9-22/h12-14H,4-11H2,1-3H3/p+1