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

Systemtic Name: 2-[(2S)-4-(cyclohexylmethyl)-1-(3-methylbut-2-enyl)piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-(cyclohexylmethyl)-1-(3-methylbut-2-enyl)piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-(cyclohexylmethyl)-1-(3-methylbut-2-enyl)-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-4-(cyclohexylmethyl)-1-(3-methylbut-2-enyl)piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-(cyclohexylmethyl)-1-(3-methylbut-2-enyl)piperazin-4-ium-2-yl]ethanol Formula: C18H35N2O+ MolecularWeight: 295.4833

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1CC[NH+](CC1CCO)CC2CCCCC2)C

Isomeric SMILES

CC(=CCN1CC[NH+](C[C@@H]1CCO)CC2CCCCC2)C

InChI

InChI=1S/C18H34N2O/c1-16(2)8-10-20-12-11-19(15-18(20)9-13-21)14-17-6-4-3-5-7-17/h8,17-18,21H,3-7,9-15H2,1-2H3/p+1/t18-/m0/s1