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

Systemtic Name: 3-ethyl-6,7-dimethoxy-2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)quinoline Openeye Name: 3-ethyl-6,7-dimethoxy-2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)quinoline CAS Name: 3-ethyl-6,7-dimethoxy-2-[2-(1-pyrrolidin-1-iumyl)ethylthio]quinoline IUPAC Name: 3-ethyl-6,7-dimethoxy-2-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)quinoline Traditional Name: 3-ethyl-6,7-dimethoxy-2-(2-pyrrolidin-1-ium-1-ylethylthio)quinoline Formula: C19H27N2O2S+ MolecularWeight: 347.49488

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=C(C(=CC2=C1)OC)OC)SCC[NH+]3CCCC3

Isomeric SMILES

CCC1=C(N=C2C=C(C(=CC2=C1)OC)OC)SCC[NH+]3CCCC3

InChI

InChI=1S/C19H26N2O2S/c1-4-14-11-15-12-17(22-2)18(23-3)13-16(15)20-19(14)24-10-9-21-7-5-6-8-21/h11-13H,4-10H2,1-3H3/p+1