[(1S)-1-[4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)phenyl]ethyl]azanium Openeye Name: [(1S)-1-[4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)phenyl]ethyl]ammonium CAS Name: [(1S)-1-[4-[4-(2-pyridin-1-iumyl)-1-piperazinyl]phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)phenyl]ethyl]azanium Traditional Name: [(1S)-1-[4-(4-pyridin-1-ium-2-ylpiperazino)phenyl]ethyl]ammonium Formula: C17H24N4+2 MolecularWeight: 284.39926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2CCN(CC2)C3=CC=CC=[NH+]3)[NH3+]

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)N2CCN(CC2)C3=CC=CC=[NH+]3)[NH3+]

InChI

InChI=1S/C17H22N4/c1-14(18)15-5-7-16(8-6-15)20-10-12-21(13-11-20)17-4-2-3-9-19-17/h2-9,14H,10-13,18H2,1H3/p+2/t14-/m0/s1