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

Systemtic Name: [(3S)-1-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]piperidin-1-ium-3-yl]methanol Openeye Name: [(3S)-1-[(5-bromo-2,4-dimethoxy-phenyl)methyl]piperidin-1-ium-3-yl]methanol CAS Name: [(3S)-1-[(5-bromo-2,4-dimethoxyphenyl)methyl]-3-piperidin-1-iumyl]methanol IUPAC Name: [(3S)-1-[(5-bromo-2,4-dimethoxyphenyl)methyl]piperidin-1-ium-3-yl]methanol Traditional Name: [(3S)-1-(5-bromo-2,4-dimethoxy-benzyl)piperidin-1-ium-3-yl]methanol Formula: C15H23BrNO3+ MolecularWeight: 345.25202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C[NH+]2CCCC(C2)CO)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1C[NH+]2CCC[C@@H](C2)CO)Br)OC

InChI

InChI=1S/C15H22BrNO3/c1-19-14-7-15(20-2)13(16)6-12(14)9-17-5-3-4-11(8-17)10-18/h6-7,11,18H,3-5,8-10H2,1-2H3/p+1/t11-/m0/s1