1-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-4-(phenylmethyl)piperidin-1-ium

Systemtic Name: 1-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-4-(phenylmethyl)piperidin-1-ium Openeye Name: 4-benzyl-1-[(3-bromo-4-fluoro-phenyl)methyl]piperidin-1-ium CAS Name: 1-[(3-bromo-4-fluorophenyl)methyl]-4-(phenylmethyl)piperidin-1-ium IUPAC Name: 4-benzyl-1-[(3-bromo-4-fluorophenyl)methyl]piperidin-1-ium Traditional Name: 4-benzyl-1-(3-bromo-4-fluoro-benzyl)piperidin-1-ium Formula: C19H22BrFN+ MolecularWeight: 363.287083

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=CC(=C(C=C3)F)Br

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=CC(=C(C=C3)F)Br

InChI

InChI=1S/C19H21BrFN/c20-18-13-17(6-7-19(18)21)14-22-10-8-16(9-11-22)12-15-4-2-1-3-5-15/h1-7,13,16H,8-12,14H2/p+1