2-(azepan-1-yl)-2-(4-bromanyl-2-fluoranyl-phenyl)ethanamine

Systemtic Name: 2-(azepan-1-yl)-2-(4-bromanyl-2-fluoranyl-phenyl)ethanamine Openeye Name: 2-(azepan-1-yl)-2-(4-bromo-2-fluoro-phenyl)ethanamine CAS Name: 2-(1-azepanyl)-2-(4-bromo-2-fluorophenyl)ethanamine IUPAC Name: 2-(azepan-1-yl)-2-(4-bromo-2-fluorophenyl)ethanamine Traditional Name: [2-(azepan-1-yl)-2-(4-bromo-2-fluoro-phenyl)ethyl]amine Formula: C14H20BrFN2 MolecularWeight: 315.224403

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CN)C2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1CCCN(CC1)C(CN)C2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C14H20BrFN2/c15-11-5-6-12(13(16)9-11)14(10-17)18-7-3-1-2-4-8-18/h5-6,9,14H,1-4,7-8,10,17H2