(2S)-1-(3-methylphenoxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2S)-1-(3-methylphenoxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol Openeye Name: (2S)-1-(3-methylphenoxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol CAS Name: (2S)-1-(3-methylphenoxy)-3-(1-pyrrolidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-(3-methylphenoxy)-3-pyrrolidin-1-ium-1-ylpropan-2-ol Traditional Name: (2S)-1-(3-methylphenoxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol Formula: C14H22NO2+ MolecularWeight: 236.32998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO2/c1-12-5-4-6-14(9-12)17-11-13(16)10-15-7-2-3-8-15/h4-6,9,13,16H,2-3,7-8,10-11H2,1H3/p+1/t13-/m0/s1