2-[(2S)-4-(2,2-dimethylpropyl)-1-(2-methylpropyl)piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-(2,2-dimethylpropyl)-1-(2-methylpropyl)piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-(2,2-dimethylpropyl)-1-isobutyl-piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-(2,2-dimethylpropyl)-1-(2-methylpropyl)-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-4-(2,2-dimethylpropyl)-1-(2-methylpropyl)piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-isobutyl-4-neopentyl-piperazin-4-ium-2-yl]ethanol Formula: C15H33N2O+ MolecularWeight: 257.43532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC[NH+](CC1CCO)CC(C)(C)C

Isomeric SMILES

CC(C)CN1CC[NH+](C[C@@H]1CCO)CC(C)(C)C

InChI

InChI=1S/C15H32N2O/c1-13(2)10-17-8-7-16(12-15(3,4)5)11-14(17)6-9-18/h13-14,18H,6-12H2,1-5H3/p+1/t14-/m0/s1