[(2S)-2-[(3R)-oxolan-3-yl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]azanium

Systemtic Name: [(2S)-2-[(3R)-oxolan-3-yl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]azanium Openeye Name: [(2S)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-[(3R)-tetrahydrofuran-3-yl]ethyl]ammonium CAS Name: [(2S)-2-[(3R)-3-oxolanyl]-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]ammonium IUPAC Name: [(2S)-2-[(3R)-oxolan-3-yl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]azanium Traditional Name: [(2S)-2-(4-pyridin-1-ium-2-ylpiperazino)-2-[(3R)-tetrahydrofuran-3-yl]ethyl]ammonium Formula: C15H26N4O+2 MolecularWeight: 278.39314

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1C(C[NH3+])N2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

C1COC[C@H]1[C@@H](C[NH3+])N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C15H24N4O/c16-11-14(13-4-10-20-12-13)18-6-8-19(9-7-18)15-3-1-2-5-17-15/h1-3,5,13-14H,4,6-12,16H2/p+2/t13-,14+/m0/s1