[(2R)-2-oxidanylpropyl]-[(2S)-2-oxidanylpropyl]-[(3R)-3-phenylbutyl]azanium

Systemtic Name: [(2R)-2-oxidanylpropyl]-[(2S)-2-oxidanylpropyl]-[(3R)-3-phenylbutyl]azanium Openeye Name: [(2R)-2-hydroxypropyl]-[(2S)-2-hydroxypropyl]-[(3R)-3-phenylbutyl]ammonium CAS Name: [(2R)-2-hydroxypropyl]-[(2S)-2-hydroxypropyl]-[(3R)-3-phenylbutyl]ammonium IUPAC Name: [(2R)-2-hydroxypropyl]-[(2S)-2-hydroxypropyl]-[(3R)-3-phenylbutyl]azanium Traditional Name: [(2R)-2-hydroxypropyl]-[(2S)-2-hydroxypropyl]-[(3R)-3-phenylbutyl]ammonium Formula: C16H28NO2+ MolecularWeight: 266.39902

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC[NH+](CC(C)O)CC(C)O)C1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO2/c1-13(16-7-5-4-6-8-16)9-10-17(11-14(2)18)12-15(3)19/h4-8,13-15,18-19H,9-12H2,1-3H3/p+1/t13-,14-,15+/m1/s1