[4-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-yl]phenyl]methylazanium

Systemtic Name: [4-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-yl]phenyl]methylazanium Openeye Name: [4-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-yl]phenyl]methylammonium CAS Name: [4-[4-[2-(4-methylphenoxy)ethyl]-1-piperazin-4-iumyl]phenyl]methylammonium IUPAC Name: [4-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-yl]phenyl]methylazanium Traditional Name: [4-[4-[2-(4-methylphenoxy)ethyl]piperazin-4-ium-1-yl]benzyl]ammonium Formula: C20H29N3O+2 MolecularWeight: 327.46376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C3=CC=C(C=C3)C[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C3=CC=C(C=C3)C[NH3+]

InChI

InChI=1S/C20H27N3O/c1-17-2-8-20(9-3-17)24-15-14-22-10-12-23(13-11-22)19-6-4-18(16-21)5-7-19/h2-9H,10-16,21H2,1H3/p+2