N-[[2-(azepan-1-yl)-4-bromanyl-phenyl]methyl]ethanamine

Systemtic Name: N-[[2-(azepan-1-yl)-4-bromanyl-phenyl]methyl]ethanamine Openeye Name: N-[[2-(azepan-1-yl)-4-bromo-phenyl]methyl]ethanamine CAS Name: N-[[2-(1-azepanyl)-4-bromophenyl]methyl]ethanamine IUPAC Name: N-[[2-(azepan-1-yl)-4-bromophenyl]methyl]ethanamine Traditional Name: [2-(azepan-1-yl)-4-bromo-benzyl]-ethyl-amine Formula: C15H23BrN2 MolecularWeight: 311.26052

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=C(C=C(C=C1)Br)N2CCCCCC2

Isomeric SMILES

CCNCC1=C(C=C(C=C1)Br)N2CCCCCC2

InChI

InChI=1S/C15H23BrN2/c1-2-17-12-13-7-8-14(16)11-15(13)18-9-5-3-4-6-10-18/h7-8,11,17H,2-6,9-10,12H2,1H3