[2-[4-(3-methoxypropyl)piperazin-4-ium-1-yl]phenyl]methylazanium

Systemtic Name: [2-[4-(3-methoxypropyl)piperazin-4-ium-1-yl]phenyl]methylazanium Openeye Name: [2-[4-(3-methoxypropyl)piperazin-4-ium-1-yl]phenyl]methylammonium CAS Name: [2-[4-(3-methoxypropyl)-1-piperazin-4-iumyl]phenyl]methylammonium IUPAC Name: [2-[4-(3-methoxypropyl)piperazin-4-ium-1-yl]phenyl]methylazanium Traditional Name: [2-[4-(3-methoxypropyl)piperazin-4-ium-1-yl]benzyl]ammonium Formula: C15H27N3O+2 MolecularWeight: 265.39438

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Descriptors Computed from Structure

Canonical SMILES:

COCCC[NH+]1CCN(CC1)C2=CC=CC=C2C[NH3+]

Isomeric SMILES

COCCC[NH+]1CCN(CC1)C2=CC=CC=C2C[NH3+]

InChI

InChI=1S/C15H25N3O/c1-19-12-4-7-17-8-10-18(11-9-17)15-6-3-2-5-14(15)13-16/h2-3,5-6H,4,7-13,16H2,1H3/p+2