(2R)-1-[(3S)-3-methylpiperidin-1-ium-1-yl]-3-(2-prop-2-enylphenoxy)propan-2-ol

Systemtic Name: (2R)-1-[(3S)-3-methylpiperidin-1-ium-1-yl]-3-(2-prop-2-enylphenoxy)propan-2-ol Openeye Name: (2R)-1-(2-allylphenoxy)-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-[(3S)-3-methyl-1-piperidin-1-iumyl]-3-(2-prop-2-enylphenoxy)-2-propanol IUPAC Name: (2R)-1-[(3S)-3-methylpiperidin-1-ium-1-yl]-3-(2-prop-2-enylphenoxy)propan-2-ol Traditional Name: (2R)-1-(2-allylphenoxy)-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propan-2-ol Formula: C18H28NO2+ MolecularWeight: 290.42042

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(COC2=CC=CC=C2CC=C)O

Isomeric SMILES

C[C@H]1CCC[NH+](C1)C[C@H](COC2=CC=CC=C2CC=C)O

InChI

InChI=1S/C18H27NO2/c1-3-7-16-9-4-5-10-18(16)21-14-17(20)13-19-11-6-8-15(2)12-19/h3-5,9-10,15,17,20H,1,6-8,11-14H2,2H3/p+1/t15-,17+/m0/s1