(3-ethoxy-2-oxidanyl-phenyl)methyl-(3-piperidin-1-ium-1-ylpropyl)azanium

Systemtic Name: (3-ethoxy-2-oxidanyl-phenyl)methyl-(3-piperidin-1-ium-1-ylpropyl)azanium Openeye Name: (3-ethoxy-2-hydroxy-phenyl)methyl-(3-piperidin-1-ium-1-ylpropyl)ammonium CAS Name: (3-ethoxy-2-hydroxyphenyl)methyl-[3-(1-piperidin-1-iumyl)propyl]ammonium IUPAC Name: (3-ethoxy-2-hydroxyphenyl)methyl-(3-piperidin-1-ium-1-ylpropyl)azanium Traditional Name: (3-ethoxy-2-hydroxy-benzyl)-(3-piperidin-1-ium-1-ylpropyl)ammonium Formula: C17H30N2O2+2 MolecularWeight: 294.4323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)C[NH2+]CCC[NH+]2CCCCC2

Isomeric SMILES

CCOC1=CC=CC(=C1O)C[NH2+]CCC[NH+]2CCCCC2

InChI

InChI=1S/C17H28N2O2/c1-2-21-16-9-6-8-15(17(16)20)14-18-10-7-13-19-11-4-3-5-12-19/h6,8-9,18,20H,2-5,7,10-14H2,1H3/p+2