(1R,2R)-2-methyl-3-(1-oxidanidylpyrrolidin-1-ium-1-yl)-1-phenyl-butan-1-ol

Systemtic Name: (1R,2R)-2-methyl-3-(1-oxidanidylpyrrolidin-1-ium-1-yl)-1-phenyl-butan-1-ol Openeye Name: (1R,2R)-2-methyl-3-(1-oxidopyrrolidin-1-ium-1-yl)-1-phenyl-butan-1-ol CAS Name: (1R,2R)-2-methyl-3-(1-oxido-1-pyrrolidin-1-iumyl)-1-phenyl-1-butanol IUPAC Name: (1R,2R)-2-methyl-3-(1-oxidopyrrolidin-1-ium-1-yl)-1-phenylbutan-1-ol Traditional Name: (1R,2R)-2-methyl-3-(1-oxidopyrrolidin-1-ium-1-yl)-1-phenyl-butan-1-ol Formula: C15H23NO2 MolecularWeight: 249.34862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)[N+]1(CCCC1)[O-])C(C2=CC=CC=C2)O

Isomeric SMILES

C[C@@H]([C@H](C1=CC=CC=C1)O)C(C)[N+]2(CCCC2)[O-]

InChI

InChI=1S/C15H23NO2/c1-12(13(2)16(18)10-6-7-11-16)15(17)14-8-4-3-5-9-14/h3-5,8-9,12-13,15,17H,6-7,10-11H2,1-2H3/t12-,13?,15-/m1/s1