[(2S)-1-[(5-bromanyl-2-methoxy-phenyl)methyl]pyrrolidin-1-ium-2-yl]methanol

Systemtic Name: [(2S)-1-[(5-bromanyl-2-methoxy-phenyl)methyl]pyrrolidin-1-ium-2-yl]methanol Openeye Name: [(2S)-1-[(5-bromo-2-methoxy-phenyl)methyl]pyrrolidin-1-ium-2-yl]methanol CAS Name: [(2S)-1-[(5-bromo-2-methoxyphenyl)methyl]-2-pyrrolidin-1-iumyl]methanol IUPAC Name: [(2S)-1-[(5-bromo-2-methoxyphenyl)methyl]pyrrolidin-1-ium-2-yl]methanol Traditional Name: [(2S)-1-(5-bromo-2-methoxy-benzyl)pyrrolidin-1-ium-2-yl]methanol Formula: C13H19BrNO2+ MolecularWeight: 301.19946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C[NH+]2CCCC2CO

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C[NH+]2CCC[C@H]2CO

InChI

InChI=1S/C13H18BrNO2/c1-17-13-5-4-11(14)7-10(13)8-15-6-2-3-12(15)9-16/h4-5,7,12,16H,2-3,6,8-9H2,1H3/p+1/t12-/m0/s1