2-[4-[(2S)-4-(4-methoxyphenyl)butan-2-yl]piperazin-4-ium-1-yl]ethanol

Systemtic Name: 2-[4-[(2S)-4-(4-methoxyphenyl)butan-2-yl]piperazin-4-ium-1-yl]ethanol Openeye Name: 2-[4-[(1S)-3-(4-methoxyphenyl)-1-methyl-propyl]piperazin-4-ium-1-yl]ethanol CAS Name: 2-[4-[(2S)-4-(4-methoxyphenyl)butan-2-yl]-1-piperazin-4-iumyl]ethanol IUPAC Name: 2-[4-[(2S)-4-(4-methoxyphenyl)butan-2-yl]piperazin-4-ium-1-yl]ethanol Traditional Name: 2-[4-[(1S)-3-(4-methoxyphenyl)-1-methyl-propyl]piperazin-4-ium-1-yl]ethanol Formula: C17H29N2O2+ MolecularWeight: 293.42436

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)OC)[NH+]2CCN(CC2)CCO

Isomeric SMILES

C[C@@H](CCC1=CC=C(C=C1)OC)[NH+]2CCN(CC2)CCO

InChI

InChI=1S/C17H28N2O2/c1-15(19-11-9-18(10-12-19)13-14-20)3-4-16-5-7-17(21-2)8-6-16/h5-8,15,20H,3-4,9-14H2,1-2H3/p+1/t15-/m0/s1