3-bromanyl-4-[[1-(methoxymethyl)pyrrolidin-1-ium-1-yl]methyl]benzoic acid

Systemtic Name: 3-bromanyl-4-[[1-(methoxymethyl)pyrrolidin-1-ium-1-yl]methyl]benzoic acid Openeye Name: 3-bromo-4-[[1-(methoxymethyl)pyrrolidin-1-ium-1-yl]methyl]benzoic acid CAS Name: 3-bromo-4-[[1-(methoxymethyl)-1-pyrrolidin-1-iumyl]methyl]benzoic acid IUPAC Name: 3-bromo-4-[[1-(methoxymethyl)pyrrolidin-1-ium-1-yl]methyl]benzoic acid Traditional Name: 3-bromo-4-[[1-(methoxymethyl)pyrrolidin-1-ium-1-yl]methyl]benzoic acid Formula: C14H19BrNO3+ MolecularWeight: 329.20956

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Descriptors Computed from Structure

Canonical SMILES:

COC[N+]1(CCCC1)CC2=C(C=C(C=C2)C(=O)O)Br

Isomeric SMILES

COC[N+]1(CCCC1)CC2=C(C=C(C=C2)C(=O)O)Br

InChI

InChI=1S/C14H18BrNO3/c1-19-10-16(6-2-3-7-16)9-12-5-4-11(14(17)18)8-13(12)15/h4-5,8H,2-3,6-7,9-10H2,1H3/p+1