(3S)-1-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]-3-methyl-piperidin-1-ium

Systemtic Name: (3S)-1-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]-3-methyl-piperidin-1-ium Openeye Name: (3S)-1-[(5-bromo-2,4-dimethoxy-phenyl)methyl]-3-methyl-piperidin-1-ium CAS Name: (3S)-1-[(5-bromo-2,4-dimethoxyphenyl)methyl]-3-methylpiperidin-1-ium IUPAC Name: (3S)-1-[(5-bromo-2,4-dimethoxyphenyl)methyl]-3-methylpiperidin-1-ium Traditional Name: (3S)-1-(5-bromo-2,4-dimethoxy-benzyl)-3-methyl-piperidin-1-ium Formula: C15H23BrNO2+ MolecularWeight: 329.25262

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=CC(=C(C=C2OC)OC)Br

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=CC(=C(C=C2OC)OC)Br

InChI

InChI=1S/C15H22BrNO2/c1-11-5-4-6-17(9-11)10-12-7-13(16)15(19-3)8-14(12)18-2/h7-8,11H,4-6,9-10H2,1-3H3/p+1/t11-/m0/s1