(2S)-4-methyl-2-phenyl-1-[[(2S)-piperidin-1-ium-2-yl]methyl]piperazin-4-ium

Systemtic Name: (2S)-4-methyl-2-phenyl-1-[[(2S)-piperidin-1-ium-2-yl]methyl]piperazin-4-ium Openeye Name: (2S)-4-methyl-2-phenyl-1-[[(2S)-piperidin-1-ium-2-yl]methyl]piperazin-4-ium CAS Name: (2S)-4-methyl-2-phenyl-1-[[(2S)-2-piperidin-1-iumyl]methyl]piperazin-4-ium IUPAC Name: (2S)-4-methyl-2-phenyl-1-[[(2S)-piperidin-1-ium-2-yl]methyl]piperazin-4-ium Traditional Name: (2S)-4-methyl-2-phenyl-1-[[(2S)-piperidin-1-ium-2-yl]methyl]piperazin-4-ium Formula: C17H29N3+2 MolecularWeight: 275.43226

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)CC3CCCC[NH2+]3

Isomeric SMILES

C[NH+]1CCN([C@H](C1)C2=CC=CC=C2)C[C@@H]3CCCC[NH2+]3

InChI

InChI=1S/C17H27N3/c1-19-11-12-20(13-16-9-5-6-10-18-16)17(14-19)15-7-3-2-4-8-15/h2-4,7-8,16-18H,5-6,9-14H2,1H3/p+2/t16-,17+/m0/s1