[4-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]phenyl]methylazanium

Systemtic Name: [4-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]phenyl]methylazanium Openeye Name: [4-[4-(2-pyridylmethyl)piperazin-4-ium-1-yl]phenyl]methylammonium CAS Name: [4-[4-(2-pyridinylmethyl)-1-piperazin-4-iumyl]phenyl]methylammonium IUPAC Name: [4-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]phenyl]methylazanium Traditional Name: [4-[4-(2-pyridylmethyl)piperazin-4-ium-1-yl]benzyl]ammonium Formula: C17H24N4+2 MolecularWeight: 284.39926

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=N2)C3=CC=C(C=C3)C[NH3+]

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=N2)C3=CC=C(C=C3)C[NH3+]

InChI

InChI=1S/C17H22N4/c18-13-15-4-6-17(7-5-15)21-11-9-20(10-12-21)14-16-3-1-2-8-19-16/h1-8H,9-14,18H2/p+2