2-[(2S)-4-(2-ethylbutyl)-1-[(3-methoxyphenyl)methyl]piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-(2-ethylbutyl)-1-[(3-methoxyphenyl)methyl]piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-(2-ethylbutyl)-1-[(3-methoxyphenyl)methyl]piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-(2-ethylbutyl)-1-[(3-methoxyphenyl)methyl]-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-4-(2-ethylbutyl)-1-[(3-methoxyphenyl)methyl]piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-(2-ethylbutyl)-1-m-anisyl-piperazin-4-ium-2-yl]ethanol Formula: C20H35N2O2+ MolecularWeight: 335.5041

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C[NH+]1CCN(C(C1)CCO)CC2=CC(=CC=C2)OC

Isomeric SMILES

CCC(CC)C[NH+]1CCN([C@H](C1)CCO)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C20H34N2O2/c1-4-17(5-2)14-21-10-11-22(19(16-21)9-12-23)15-18-7-6-8-20(13-18)24-3/h6-8,13,17,19,23H,4-5,9-12,14-16H2,1-3H3/p+1/t19-/m0/s1