(2S)-1-[(6-chloranylpyridin-3-yl)methyl]-4-methyl-2-phenyl-piperazin-4-ium

Systemtic Name: (2S)-1-[(6-chloranylpyridin-3-yl)methyl]-4-methyl-2-phenyl-piperazin-4-ium Openeye Name: (2S)-1-[(6-chloro-3-pyridyl)methyl]-4-methyl-2-phenyl-piperazin-4-ium CAS Name: (2S)-1-[(6-chloro-3-pyridinyl)methyl]-4-methyl-2-phenylpiperazin-4-ium IUPAC Name: (2S)-1-[(6-chloropyridin-3-yl)methyl]-4-methyl-2-phenylpiperazin-4-ium Traditional Name: (2S)-1-[(6-chloro-3-pyridyl)methyl]-4-methyl-2-phenyl-piperazin-4-ium Formula: C17H21ClN3+ MolecularWeight: 302.82174

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)CC3=CN=C(C=C3)Cl

Isomeric SMILES

C[NH+]1CCN([C@H](C1)C2=CC=CC=C2)CC3=CN=C(C=C3)Cl

InChI

InChI=1S/C17H20ClN3/c1-20-9-10-21(12-14-7-8-17(18)19-11-14)16(13-20)15-5-3-2-4-6-15/h2-8,11,16H,9-10,12-13H2,1H3/p+1/t16-/m1/s1