(2S)-1-[(1R)-1-phenylpropoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2S)-1-[(1R)-1-phenylpropoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol Openeye Name: (2S)-1-[(1R)-1-phenylpropoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol CAS Name: (2S)-1-[(1R)-1-phenylpropoxy]-3-(1-pyrrolidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-[(1R)-1-phenylpropoxy]-3-pyrrolidin-1-ium-1-ylpropan-2-ol Traditional Name: (2S)-1-[(1R)-1-phenylpropoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol Formula: C16H26NO2+ MolecularWeight: 264.38314

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)OCC(C[NH+]2CCCC2)O

Isomeric SMILES

CC[C@H](C1=CC=CC=C1)OC[C@H](C[NH+]2CCCC2)O

InChI

InChI=1S/C16H25NO2/c1-2-16(14-8-4-3-5-9-14)19-13-15(18)12-17-10-6-7-11-17/h3-5,8-9,15-16,18H,2,6-7,10-13H2,1H3/p+1/t15-,16+/m0/s1