[(2S)-2-[(4-methylpiperazin-4-ium-1-yl)methyl]-3-pyridin-4-yl-propyl]azanium

Systemtic Name: [(2S)-2-[(4-methylpiperazin-4-ium-1-yl)methyl]-3-pyridin-4-yl-propyl]azanium Openeye Name: [(2S)-2-[(4-methylpiperazin-4-ium-1-yl)methyl]-3-(4-pyridyl)propyl]ammonium CAS Name: [(2S)-2-[(4-methyl-1-piperazin-4-iumyl)methyl]-3-pyridin-4-ylpropyl]ammonium IUPAC Name: [(2S)-2-[(4-methylpiperazin-4-ium-1-yl)methyl]-3-pyridin-4-ylpropyl]azanium Traditional Name: [(2S)-2-[(4-methylpiperazin-4-ium-1-yl)methyl]-3-(4-pyridyl)propyl]ammonium Formula: C14H26N4+2 MolecularWeight: 250.38304

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC(CC2=CC=NC=C2)C[NH3+]

Isomeric SMILES

C[NH+]1CCN(CC1)C[C@@H](CC2=CC=NC=C2)C[NH3+]

InChI

InChI=1S/C14H24N4/c1-17-6-8-18(9-7-17)12-14(11-15)10-13-2-4-16-5-3-13/h2-5,14H,6-12,15H2,1H3/p+2/t14-/m0/s1