[1-[2-(2-prop-2-enylphenoxy)ethyl]piperidin-1-ium-4-yl]methylazanium

Systemtic Name: [1-[2-(2-prop-2-enylphenoxy)ethyl]piperidin-1-ium-4-yl]methylazanium Openeye Name: [1-[2-(2-allylphenoxy)ethyl]piperidin-1-ium-4-yl]methylammonium CAS Name: [1-[2-(2-prop-2-enylphenoxy)ethyl]-4-piperidin-1-iumyl]methylammonium IUPAC Name: [1-[2-(2-prop-2-enylphenoxy)ethyl]piperidin-1-ium-4-yl]methylazanium Traditional Name: [1-[2-(2-allylphenoxy)ethyl]piperidin-1-ium-4-yl]methylammonium Formula: C17H28N2O+2 MolecularWeight: 276.41702

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1OCC[NH+]2CCC(CC2)C[NH3+]

Isomeric SMILES

C=CCC1=CC=CC=C1OCC[NH+]2CCC(CC2)C[NH3+]

InChI

InChI=1S/C17H26N2O/c1-2-5-16-6-3-4-7-17(16)20-13-12-19-10-8-15(14-18)9-11-19/h2-4,6-7,15H,1,5,8-14,18H2/p+2