(2S)-1-pyrrolidin-1-ium-1-yl-3-(2,4,6-trimethylphenoxy)propan-2-ol

Systemtic Name: (2S)-1-pyrrolidin-1-ium-1-yl-3-(2,4,6-trimethylphenoxy)propan-2-ol Openeye Name: (2S)-1-pyrrolidin-1-ium-1-yl-3-(2,4,6-trimethylphenoxy)propan-2-ol CAS Name: (2S)-1-(1-pyrrolidin-1-iumyl)-3-(2,4,6-trimethylphenoxy)-2-propanol IUPAC Name: (2S)-1-pyrrolidin-1-ium-1-yl-3-(2,4,6-trimethylphenoxy)propan-2-ol Traditional Name: (2S)-1-pyrrolidin-1-ium-1-yl-3-(2,4,6-trimethylphenoxy)propan-2-ol Formula: C16H26NO2+ MolecularWeight: 264.38314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCC(C[NH+]2CCCC2)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OC[C@H](C[NH+]2CCCC2)O)C

InChI

InChI=1S/C16H25NO2/c1-12-8-13(2)16(14(3)9-12)19-11-15(18)10-17-6-4-5-7-17/h8-9,15,18H,4-7,10-11H2,1-3H3/p+1/t15-/m0/s1