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

Systemtic Name: [(2S)-4-methyl-1-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]pentan-2-yl]azanium Openeye Name: [(1S)-3-methyl-1-[[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methyl]butyl]ammonium CAS Name: [(2S)-4-methyl-1-[(2S)-4-methyl-2-phenyl-1-piperazin-4-iumyl]pentan-2-yl]ammonium IUPAC Name: [(2S)-4-methyl-1-[(2S)-4-methyl-2-phenylpiperazin-4-ium-1-yl]pentan-2-yl]azanium Traditional Name: [(1S)-3-methyl-1-[[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methyl]butyl]ammonium Formula: C17H31N3+2 MolecularWeight: 277.44814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CN1CC[NH+](CC1C2=CC=CC=C2)C)[NH3+]

Isomeric SMILES

CC(C)C[C@@H](CN1CC[NH+](C[C@@H]1C2=CC=CC=C2)C)[NH3+]

InChI

InChI=1S/C17H29N3/c1-14(2)11-16(18)12-20-10-9-19(3)13-17(20)15-7-5-4-6-8-15/h4-8,14,16-17H,9-13,18H2,1-3H3/p+2/t16-,17+/m0/s1