dimethyl-[3-[[2-[4-(phenylmethyl)piperidin-1-yl]pyridin-1-ium-3-yl]carbonylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[[2-[4-(phenylmethyl)piperidin-1-yl]pyridin-1-ium-3-yl]carbonylamino]propyl]azanium Openeye Name: 3-[[2-(4-benzyl-1-piperidyl)pyridin-1-ium-3-carbonyl]amino]propyl-dimethyl-ammonium CAS Name: dimethyl-[3-[[oxo-[2-[4-(phenylmethyl)-1-piperidinyl]-3-pyridin-1-iumyl]methyl]amino]propyl]ammonium IUPAC Name: 3-[[2-(4-benzylpiperidin-1-yl)pyridin-1-ium-3-carbonyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(4-benzylpiperidino)pyridin-1-ium-3-carbonyl]amino]propyl-dimethyl-ammonium Formula: C23H34N4O+2 MolecularWeight: 382.54226

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C1=C([NH+]=CC=C1)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCCNC(=O)C1=C([NH+]=CC=C1)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H32N4O/c1-26(2)15-7-14-25-23(28)21-10-6-13-24-22(21)27-16-11-20(12-17-27)18-19-8-4-3-5-9-19/h3-6,8-10,13,20H,7,11-12,14-18H2,1-2H3,(H,25,28)/p+2