4-[[(5-bromanyl-2-fluoranyl-phenyl)methyl-propyl-amino]methyl]aniline

Systemtic Name: 4-[[(5-bromanyl-2-fluoranyl-phenyl)methyl-propyl-amino]methyl]aniline Openeye Name: 4-[[(5-bromo-2-fluoro-phenyl)methyl-propyl-amino]methyl]aniline CAS Name: 4-[[(5-bromo-2-fluorophenyl)methyl-propylamino]methyl]aniline IUPAC Name: 4-[[(5-bromo-2-fluorophenyl)methyl-propylamino]methyl]aniline Traditional Name: (4-aminobenzyl)-(5-bromo-2-fluoro-benzyl)-propyl-amine Formula: C17H20BrFN2 MolecularWeight: 351.256503

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=C(C=C1)N)CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)N)CC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C17H20BrFN2/c1-2-9-21(11-13-3-6-16(20)7-4-13)12-14-10-15(18)5-8-17(14)19/h3-8,10H,2,9,11-12,20H2,1H3