(2R)-1-[2-[(2S,6S)-6-methyl-4-methylidene-oxan-2-yl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2R)-1-[2-[(2S,6S)-6-methyl-4-methylidene-oxan-2-yl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol Openeye Name: (2R)-1-[2-[(2S,6S)-6-methyl-4-methylene-tetrahydropyran-2-yl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol CAS Name: (2R)-1-[2-[(2S,6S)-6-methyl-4-methylene-2-oxanyl]phenoxy]-3-(1-piperidin-1-iumyl)-2-propanol IUPAC Name: (2R)-1-[2-[(2S,6S)-6-methyl-4-methylideneoxan-2-yl]phenoxy]-3-piperidin-1-ium-1-ylpropan-2-ol Traditional Name: (2R)-1-[2-[(2S,6S)-6-methyl-4-methylene-tetrahydropyran-2-yl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol Formula: C21H32NO3+ MolecularWeight: 346.48368

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=C)CC(O1)C2=CC=CC=C2OCC(C[NH+]3CCCCC3)O

Isomeric SMILES

C[C@H]1CC(=C)C[C@H](O1)C2=CC=CC=C2OC[C@@H](C[NH+]3CCCCC3)O

InChI

InChI=1S/C21H31NO3/c1-16-12-17(2)25-21(13-16)19-8-4-5-9-20(19)24-15-18(23)14-22-10-6-3-7-11-22/h4-5,8-9,17-18,21,23H,1,3,6-7,10-15H2,2H3/p+1/t17-,18+,21-/m0/s1