2-hydroxyethyl-[[3-methoxy-2-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]azanium

Systemtic Name: 2-hydroxyethyl-[[3-methoxy-2-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]azanium Openeye Name: 2-hydroxyethyl-[[3-methoxy-2-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]ammonium CAS Name: 2-hydroxyethyl-[[3-methoxy-2-[2-(1-piperidin-1-iumyl)ethoxy]phenyl]methyl]ammonium IUPAC Name: 2-hydroxyethyl-[[3-methoxy-2-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]azanium Traditional Name: 2-hydroxyethyl-[3-methoxy-2-(2-piperidin-1-ium-1-ylethoxy)benzyl]ammonium Formula: C17H30N2O3+2 MolecularWeight: 310.4317

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC[NH+]2CCCCC2)C[NH2+]CCO

Isomeric SMILES

COC1=CC=CC(=C1OCC[NH+]2CCCCC2)C[NH2+]CCO

InChI

InChI=1S/C17H28N2O3/c1-21-16-7-5-6-15(14-18-8-12-20)17(16)22-13-11-19-9-3-2-4-10-19/h5-7,18,20H,2-4,8-14H2,1H3/p+2