(2S)-4-methyl-2-phenyl-1-piperidin-4-yl-piperazine-1,4-diium

Systemtic Name: (2S)-4-methyl-2-phenyl-1-piperidin-4-yl-piperazine-1,4-diium Openeye Name: (2S)-4-methyl-2-phenyl-1-(4-piperidyl)piperazine-1,4-diium CAS Name: (2S)-4-methyl-2-phenyl-1-(4-piperidinyl)piperazine-1,4-diium IUPAC Name: (2S)-4-methyl-2-phenyl-1-piperidin-4-ylpiperazine-1,4-diium Traditional Name: (2S)-4-methyl-2-phenyl-1-(4-piperidyl)piperazine-1,4-diium Formula: C16H27N3+2 MolecularWeight: 261.40568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](C(C1)C2=CC=CC=C2)C3CCNCC3

Isomeric SMILES

C[NH+]1CC[NH+]([C@H](C1)C2=CC=CC=C2)C3CCNCC3

InChI

InChI=1S/C16H25N3/c1-18-11-12-19(15-7-9-17-10-8-15)16(13-18)14-5-3-2-4-6-14/h2-6,15-17H,7-13H2,1H3/p+2/t16-/m1/s1