(2R)-1-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]-3-(2-methoxy-4-prop-2-enyl-phenoxy)propan-2-ol

Systemtic Name: (2R)-1-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]-3-(2-methoxy-4-prop-2-enyl-phenoxy)propan-2-ol Openeye Name: (2R)-1-(4-allyl-2-methoxy-phenoxy)-3-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-[(2S,6S)-2,6-dimethyl-1-piperidin-1-iumyl]-3-(2-methoxy-4-prop-2-enylphenoxy)-2-propanol IUPAC Name: (2R)-1-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]-3-(2-methoxy-4-prop-2-enylphenoxy)propan-2-ol Traditional Name: (2R)-1-(4-allyl-2-methoxy-phenoxy)-3-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]propan-2-ol Formula: C20H32NO3+ MolecularWeight: 334.47298

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1CC(COC2=C(C=C(C=C2)CC=C)OC)O)C

Isomeric SMILES

C[C@H]1CCC[C@@H]([NH+]1C[C@H](COC2=C(C=C(C=C2)CC=C)OC)O)C

InChI

InChI=1S/C20H31NO3/c1-5-7-17-10-11-19(20(12-17)23-4)24-14-18(22)13-21-15(2)8-6-9-16(21)3/h5,10-12,15-16,18,22H,1,6-9,13-14H2,2-4H3/p+1/t15-,16-,18+/m0/s1