1-[[3,5-bis(bromomethyl)phenyl]methyl]-4-pyrrolidin-1-yl-pyridin-1-ium

Systemtic Name: 1-[[3,5-bis(bromomethyl)phenyl]methyl]-4-pyrrolidin-1-yl-pyridin-1-ium Openeye Name: 1-[[3,5-bis(bromomethyl)phenyl]methyl]-4-pyrrolidin-1-yl-pyridin-1-ium CAS Name: 1-[[3,5-bis(bromomethyl)phenyl]methyl]-4-(1-pyrrolidinyl)pyridin-1-ium IUPAC Name: 1-[[3,5-bis(bromomethyl)phenyl]methyl]-4-pyrrolidin-1-ylpyridin-1-ium Traditional Name: 1-[3,5-bis(bromomethyl)benzyl]-4-pyrrolidino-pyridin-1-ium Formula: C18H21Br2N2+ MolecularWeight: 425.18074

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=[N+](C=C2)CC3=CC(=CC(=C3)CBr)CBr

Isomeric SMILES

C1CCN(C1)C2=CC=[N+](C=C2)CC3=CC(=CC(=C3)CBr)CBr

InChI

InChI=1S/C18H21Br2N2/c19-12-15-9-16(13-20)11-17(10-15)14-21-7-3-18(4-8-21)22-5-1-2-6-22/h3-4,7-11H,1-2,5-6,12-14H2/q+1