2-methoxyethyl-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-(thian-4-yl)azanium

Systemtic Name: 2-methoxyethyl-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-(thian-4-yl)azanium Openeye Name: 2-methoxyethyl-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-tetrahydrothiopyran-4-yl-ammonium CAS Name: 2-methoxyethyl-[[1-[(2-methoxyphenyl)methyl]-4-piperidin-1-iumyl]methyl]-(4-thianyl)ammonium IUPAC Name: 2-methoxyethyl-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-(thian-4-yl)azanium Traditional Name: 2-methoxyethyl-[(1-o-anisylpiperidin-1-ium-4-yl)methyl]-tetrahydrothiopyran-4-yl-ammonium Formula: C22H38N2O2S+2 MolecularWeight: 394.61432

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+](CC1CC[NH+](CC1)CC2=CC=CC=C2OC)C3CCSCC3

Isomeric SMILES

COCC[NH+](CC1CC[NH+](CC1)CC2=CC=CC=C2OC)C3CCSCC3

InChI

InChI=1S/C22H36N2O2S/c1-25-14-13-24(21-9-15-27-16-10-21)17-19-7-11-23(12-8-19)18-20-5-3-4-6-22(20)26-2/h3-6,19,21H,7-18H2,1-2H3/p+2