(4-ethoxyphenyl)methyl-(3-piperidin-1-ium-1-ylpropyl)azanium

Systemtic Name: (4-ethoxyphenyl)methyl-(3-piperidin-1-ium-1-ylpropyl)azanium Openeye Name: (4-ethoxyphenyl)methyl-(3-piperidin-1-ium-1-ylpropyl)ammonium CAS Name: (4-ethoxyphenyl)methyl-[3-(1-piperidin-1-iumyl)propyl]ammonium IUPAC Name: (4-ethoxyphenyl)methyl-(3-piperidin-1-ium-1-ylpropyl)azanium Traditional Name: (4-ethoxybenzyl)-(3-piperidin-1-ium-1-ylpropyl)ammonium Formula: C17H30N2O+2 MolecularWeight: 278.4329

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH2+]CCC[NH+]2CCCCC2

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH2+]CCC[NH+]2CCCCC2

InChI

InChI=1S/C17H28N2O/c1-2-20-17-9-7-16(8-10-17)15-18-11-6-14-19-12-4-3-5-13-19/h7-10,18H,2-6,11-15H2,1H3/p+2