2-[(2S)-4-[(2-ethoxyphenyl)methyl]-1-(2-methylpropyl)piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(2-ethoxyphenyl)methyl]-1-(2-methylpropyl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(2-ethoxyphenyl)methyl]-1-isobutyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(2-ethoxyphenyl)methyl]-1-(2-methylpropyl)-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(2-ethoxyphenyl)methyl]-1-(2-methylpropyl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-(2-ethoxybenzyl)-1-isobutyl-piperazin-1-ium-2-yl]ethanol Formula: C19H33N2O2+ MolecularWeight: 321.47752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN2CC[NH+](C(C2)CCO)CC(C)C

Isomeric SMILES

CCOC1=CC=CC=C1CN2CC[NH+]([C@H](C2)CCO)CC(C)C

InChI

InChI=1S/C19H32N2O2/c1-4-23-19-8-6-5-7-17(19)14-20-10-11-21(13-16(2)3)18(15-20)9-12-22/h5-8,16,18,22H,4,9-15H2,1-3H3/p+1/t18-/m0/s1