2-[(2S)-4-(3-methylbut-2-enyl)-1-(2-methylpropyl)piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-(3-methylbut-2-enyl)-1-(2-methylpropyl)piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-isobutyl-4-(3-methylbut-2-enyl)piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-(3-methylbut-2-enyl)-1-(2-methylpropyl)-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-4-(3-methylbut-2-enyl)-1-(2-methylpropyl)piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-isobutyl-4-(3-methylbut-2-enyl)piperazin-4-ium-2-yl]ethanol Formula: C15H31N2O+ MolecularWeight: 255.41944

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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/C15H30N2O/c1-13(2)5-7-16-8-9-17(11-14(3)4)15(12-16)6-10-18/h5,14-15,18H,6-12H2,1-4H3/p+1/t15-/m0/s1