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

Systemtic Name: 2-[(2S)-4-[(4-ethoxyphenyl)methyl]-1-propan-2-yl-piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(4-ethoxyphenyl)methyl]-1-isopropyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(4-ethoxyphenyl)methyl]-1-propan-2-yl-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(4-ethoxyphenyl)methyl]-1-propan-2-ylpiperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-(4-ethoxybenzyl)-1-isopropyl-piperazin-1-ium-2-yl]ethanol Formula: C18H31N2O2+ MolecularWeight: 307.45094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2CC[NH+](C(C2)CCO)C(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2CC[NH+]([C@H](C2)CCO)C(C)C

InChI

InChI=1S/C18H30N2O2/c1-4-22-18-7-5-16(6-8-18)13-19-10-11-20(15(2)3)17(14-19)9-12-21/h5-8,15,17,21H,4,9-14H2,1-3H3/p+1/t17-/m0/s1