(2R)-1-(2,3-dimethyl-5-methylidene-1H-pyrazol-2-ium-2-yl)-3-phenoxy-propan-2-ol

Systemtic Name: (2R)-1-(2,3-dimethyl-5-methylidene-1H-pyrazol-2-ium-2-yl)-3-phenoxy-propan-2-ol Openeye Name: (2R)-1-(2,3-dimethyl-5-methylene-1H-pyrazol-2-ium-2-yl)-3-phenoxy-propan-2-ol CAS Name: (2R)-1-(2,3-dimethyl-5-methylene-1H-pyrazol-2-ium-2-yl)-3-phenoxy-2-propanol IUPAC Name: (2R)-1-(2,3-dimethyl-5-methylidene-1H-pyrazol-2-ium-2-yl)-3-phenoxypropan-2-ol Traditional Name: (2R)-1-(1,5-dimethyl-3-methylene-3-pyrazolin-1-ium-1-yl)-3-phenoxy-propan-2-ol Formula: C15H21N2O2+ MolecularWeight: 261.33944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C)N[N+]1(C)CC(COC2=CC=CC=C2)O

Isomeric SMILES

CC1=CC(=C)N[N+]1(C)C[C@H](COC2=CC=CC=C2)O

InChI

InChI=1S/C15H21N2O2/c1-12-9-13(2)17(3,16-12)10-14(18)11-19-15-7-5-4-6-8-15/h4-9,14,16,18H,1,10-11H2,2-3H3/q+1/t14-,17?/m1/s1