(2S,6S)-4-[2-(4-bromanyl-2-methyl-phenoxy)ethyl]-2,6-dimethyl-morpholin-4-ium

Systemtic Name: (2S,6S)-4-[2-(4-bromanyl-2-methyl-phenoxy)ethyl]-2,6-dimethyl-morpholin-4-ium Openeye Name: (2S,6S)-4-[2-(4-bromo-2-methyl-phenoxy)ethyl]-2,6-dimethyl-morpholin-4-ium CAS Name: (2S,6S)-4-[2-(4-bromo-2-methylphenoxy)ethyl]-2,6-dimethylmorpholin-4-ium IUPAC Name: (2S,6S)-4-[2-(4-bromo-2-methylphenoxy)ethyl]-2,6-dimethylmorpholin-4-ium Traditional Name: (2S,6S)-4-[2-(4-bromo-2-methyl-phenoxy)ethyl]-2,6-dimethyl-morpholin-4-ium Formula: C15H23BrNO2+ MolecularWeight: 329.25262

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CCOC2=C(C=C(C=C2)Br)C

Isomeric SMILES

C[C@H]1C[NH+](C[C@@H](O1)C)CCOC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C15H22BrNO2/c1-11-8-14(16)4-5-15(11)18-7-6-17-9-12(2)19-13(3)10-17/h4-5,8,12-13H,6-7,9-10H2,1-3H3/p+1/t12-,13-/m0/s1