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

Systemtic Name: (3R)-1-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]piperidin-1-ium-3-ol Openeye Name: (3R)-1-[(2-bromo-4,5-dimethoxy-phenyl)methyl]piperidin-1-ium-3-ol CAS Name: (3R)-1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-3-piperidin-1-iumol IUPAC Name: (3R)-1-[(2-bromo-4,5-dimethoxyphenyl)methyl]piperidin-1-ium-3-ol Traditional Name: (3R)-1-(2-bromo-4,5-dimethoxy-benzyl)piperidin-1-ium-3-ol Formula: C14H21BrNO3+ MolecularWeight: 331.22544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C[NH+]2CCCC(C2)O)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C[NH+]2CCC[C@H](C2)O)Br)OC

InChI

InChI=1S/C14H20BrNO3/c1-18-13-6-10(12(15)7-14(13)19-2)8-16-5-3-4-11(17)9-16/h6-7,11,17H,3-5,8-9H2,1-2H3/p+1/t11-/m1/s1