1-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]pyrrolidin-1-ium

Systemtic Name: 1-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]pyrrolidin-1-ium Openeye Name: 1-[(5-bromo-2,4-dimethoxy-phenyl)methyl]pyrrolidin-1-ium CAS Name: 1-[(5-bromo-2,4-dimethoxyphenyl)methyl]pyrrolidin-1-ium IUPAC Name: 1-[(5-bromo-2,4-dimethoxyphenyl)methyl]pyrrolidin-1-ium Traditional Name: 1-(5-bromo-2,4-dimethoxy-benzyl)pyrrolidin-1-ium Formula: C13H19BrNO2+ MolecularWeight: 301.19946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C[NH+]2CCCC2)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1C[NH+]2CCCC2)Br)OC

InChI

InChI=1S/C13H18BrNO2/c1-16-12-8-13(17-2)11(14)7-10(12)9-15-5-3-4-6-15/h7-8H,3-6,9H2,1-2H3/p+1