[5-bromanyl-3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl-methyl-azanium

Systemtic Name: [5-bromanyl-3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl-methyl-azanium Openeye Name: [5-bromo-3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl-methyl-ammonium CAS Name: [5-bromo-3-methoxy-2-[2-(1-pyrrolidin-1-iumyl)ethoxy]phenyl]methyl-methylammonium IUPAC Name: [5-bromo-3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl-methylazanium Traditional Name: [5-bromo-3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzyl]-methyl-ammonium Formula: C15H25BrN2O2+2 MolecularWeight: 345.2752

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC1=CC(=CC(=C1OCC[NH+]2CCCC2)OC)Br

Isomeric SMILES

C[NH2+]CC1=CC(=CC(=C1OCC[NH+]2CCCC2)OC)Br

InChI

InChI=1S/C15H23BrN2O2/c1-17-11-12-9-13(16)10-14(19-2)15(12)20-8-7-18-5-3-4-6-18/h9-10,17H,3-8,11H2,1-2H3/p+2