[5-[[4-[4-(cyclopropylcarbamoyl)piperidin-1-ium-1-yl]piperidin-1-yl]methyl]thiophen-3-yl]methyl-dimethyl-azanium

Systemtic Name: [5-[[4-[4-(cyclopropylcarbamoyl)piperidin-1-ium-1-yl]piperidin-1-yl]methyl]thiophen-3-yl]methyl-dimethyl-azanium Openeye Name: [5-[[4-[4-(cyclopropylcarbamoyl)piperidin-1-ium-1-yl]-1-piperidyl]methyl]-3-thienyl]methyl-dimethyl-ammonium CAS Name: [5-[[4-[4-[(cyclopropylamino)-oxomethyl]-1-piperidin-1-iumyl]-1-piperidinyl]methyl]-3-thiophenyl]methyl-dimethylammonium IUPAC Name: [5-[[4-[4-(cyclopropylcarbamoyl)piperidin-1-ium-1-yl]piperidin-1-yl]methyl]thiophen-3-yl]methyl-dimethylazanium Traditional Name: [5-[[4-[4-(cyclopropylcarbamoyl)piperidin-1-ium-1-yl]piperidino]methyl]-3-thienyl]methyl-dimethyl-ammonium Formula: C22H38N4OS+2 MolecularWeight: 406.62832

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CSC(=C1)CN2CCC(CC2)[NH+]3CCC(CC3)C(=O)NC4CC4

Isomeric SMILES

C[NH+](C)CC1=CSC(=C1)CN2CCC(CC2)[NH+]3CCC(CC3)C(=O)NC4CC4

InChI

InChI=1S/C22H36N4OS/c1-24(2)14-17-13-21(28-16-17)15-25-9-7-20(8-10-25)26-11-5-18(6-12-26)22(27)23-19-3-4-19/h13,16,18-20H,3-12,14-15H2,1-2H3,(H,23,27)/p+2