(2R)-1-[2-(4-tert-butylphenoxy)ethoxy]-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol

Systemtic Name: (2R)-1-[2-(4-tert-butylphenoxy)ethoxy]-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Openeye Name: (2R)-1-[2-(4-tert-butylphenoxy)ethoxy]-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2R)-1-[2-(4-tert-butylphenoxy)ethoxy]-3-(4-ethyl-1-piperazin-4-iumyl)-2-propanol IUPAC Name: (2R)-1-[2-(4-tert-butylphenoxy)ethoxy]-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Traditional Name: (2R)-1-[2-(4-tert-butylphenoxy)ethoxy]-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Formula: C21H37N2O3+ MolecularWeight: 365.53008

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(COCCOC2=CC=C(C=C2)C(C)(C)C)O

Isomeric SMILES

CC[NH+]1CCN(CC1)C[C@H](COCCOC2=CC=C(C=C2)C(C)(C)C)O

InChI

InChI=1S/C21H36N2O3/c1-5-22-10-12-23(13-11-22)16-19(24)17-25-14-15-26-20-8-6-18(7-9-20)21(2,3)4/h6-9,19,24H,5,10-17H2,1-4H3/p+1/t19-/m1/s1