2-[4-[1-[(2-ethoxyphenyl)methyl]piperidin-1-ium-4-yl]piperazin-4-ium-1-yl]ethanol

Systemtic Name: 2-[4-[1-[(2-ethoxyphenyl)methyl]piperidin-1-ium-4-yl]piperazin-4-ium-1-yl]ethanol Openeye Name: 2-[4-[1-[(2-ethoxyphenyl)methyl]piperidin-1-ium-4-yl]piperazin-4-ium-1-yl]ethanol CAS Name: 2-[4-[1-[(2-ethoxyphenyl)methyl]-4-piperidin-1-iumyl]-1-piperazin-4-iumyl]ethanol IUPAC Name: 2-[4-[1-[(2-ethoxyphenyl)methyl]piperidin-1-ium-4-yl]piperazin-4-ium-1-yl]ethanol Traditional Name: 2-[4-[1-(2-ethoxybenzyl)piperidin-1-ium-4-yl]piperazin-4-ium-1-yl]ethanol Formula: C20H35N3O2+2 MolecularWeight: 349.5108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C[NH+]2CCC(CC2)[NH+]3CCN(CC3)CCO

Isomeric SMILES

CCOC1=CC=CC=C1C[NH+]2CCC(CC2)[NH+]3CCN(CC3)CCO

InChI

InChI=1S/C20H33N3O2/c1-2-25-20-6-4-3-5-18(20)17-22-9-7-19(8-10-22)23-13-11-21(12-14-23)15-16-24/h3-6,19,24H,2,7-17H2,1H3/p+2