(1-methylpiperidin-1-ium-4-yl)methyl-phenethyl-(pyridin-2-ylmethyl)azanium

Systemtic Name: (1-methylpiperidin-1-ium-4-yl)methyl-phenethyl-(pyridin-2-ylmethyl)azanium Openeye Name: (1-methylpiperidin-1-ium-4-yl)methyl-phenethyl-(2-pyridylmethyl)ammonium CAS Name: (1-methyl-4-piperidin-1-iumyl)methyl-phenethyl-(2-pyridinylmethyl)ammonium IUPAC Name: (1-methylpiperidin-1-ium-4-yl)methyl-phenethyl-(pyridin-2-ylmethyl)azanium Traditional Name: (1-methylpiperidin-1-ium-4-yl)methyl-phenethyl-(2-pyridylmethyl)ammonium Formula: C21H31N3+2 MolecularWeight: 325.49094

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)C[NH+](CCC2=CC=CC=C2)CC3=CC=CC=N3

Isomeric SMILES

C[NH+]1CCC(CC1)C[NH+](CCC2=CC=CC=C2)CC3=CC=CC=N3

InChI

InChI=1S/C21H29N3/c1-23-14-10-20(11-15-23)17-24(18-21-9-5-6-13-22-21)16-12-19-7-3-2-4-8-19/h2-9,13,20H,10-12,14-18H2,1H3/p+2