3-piperidin-1-ium-1-ylpropyl-[(4-propoxyphenyl)methyl]azanium

Systemtic Name: 3-piperidin-1-ium-1-ylpropyl-[(4-propoxyphenyl)methyl]azanium Openeye Name: 3-piperidin-1-ium-1-ylpropyl-[(4-propoxyphenyl)methyl]ammonium CAS Name: 3-(1-piperidin-1-iumyl)propyl-[(4-propoxyphenyl)methyl]ammonium IUPAC Name: 3-piperidin-1-ium-1-ylpropyl-[(4-propoxyphenyl)methyl]azanium Traditional Name: 3-piperidin-1-ium-1-ylpropyl-(4-propoxybenzyl)ammonium Formula: C18H32N2O+2 MolecularWeight: 292.45948

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C[NH2+]CCC[NH+]2CCCCC2

Isomeric SMILES

CCCOC1=CC=C(C=C1)C[NH2+]CCC[NH+]2CCCCC2

InChI

InChI=1S/C18H30N2O/c1-2-15-21-18-9-7-17(8-10-18)16-19-11-6-14-20-12-4-3-5-13-20/h7-10,19H,2-6,11-16H2,1H3/p+2