7-methyl-6-(2-piperidin-1-ium-1-ylethylsulfanyl)-[1,3]dioxolo[4,5-g]quinoline

Systemtic Name: 7-methyl-6-(2-piperidin-1-ium-1-ylethylsulfanyl)-[1,3]dioxolo[4,5-g]quinoline Openeye Name: 7-methyl-6-(2-piperidin-1-ium-1-ylethylsulfanyl)-[1,3]dioxolo[4,5-g]quinoline CAS Name: 7-methyl-6-[2-(1-piperidin-1-iumyl)ethylthio]-[1,3]dioxolo[4,5-g]quinoline IUPAC Name: 7-methyl-6-(2-piperidin-1-ium-1-ylethylsulfanyl)-[1,3]dioxolo[4,5-g]quinoline Traditional Name: 7-methyl-6-(2-piperidin-1-ium-1-ylethylthio)-[1,3]dioxolo[4,5-g]quinoline Formula: C18H23N2O2S+ MolecularWeight: 331.45242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=C3C(=CC2=C1)OCO3)SCC[NH+]4CCCCC4

Isomeric SMILES

CC1=C(N=C2C=C3C(=CC2=C1)OCO3)SCC[NH+]4CCCCC4

InChI

InChI=1S/C18H22N2O2S/c1-13-9-14-10-16-17(22-12-21-16)11-15(14)19-18(13)23-8-7-20-5-3-2-4-6-20/h9-11H,2-8,12H2,1H3/p+1