(2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-phenylmethoxy-propan-2-ol

Systemtic Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-phenylmethoxy-propan-2-ol Openeye Name: (2S)-1-benzyloxy-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2S)-1-(4-ethyl-1-piperazin-4-iumyl)-3-phenylmethoxy-2-propanol IUPAC Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-phenylmethoxypropan-2-ol Traditional Name: (2S)-1-benzoxy-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Formula: C16H27N2O2+ MolecularWeight: 279.39778

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(COCC2=CC=CC=C2)O

Isomeric SMILES

CC[NH+]1CCN(CC1)C[C@@H](COCC2=CC=CC=C2)O

InChI

InChI=1S/C16H26N2O2/c1-2-17-8-10-18(11-9-17)12-16(19)14-20-13-15-6-4-3-5-7-15/h3-7,16,19H,2,8-14H2,1H3/p+1/t16-/m0/s1