2-(azepan-1-ylmethyl)-4-bromanyl-6-(trifluoromethyl)aniline

Systemtic Name: 2-(azepan-1-ylmethyl)-4-bromanyl-6-(trifluoromethyl)aniline Openeye Name: 2-(azepan-1-ylmethyl)-4-bromo-6-(trifluoromethyl)aniline CAS Name: 2-(1-azepanylmethyl)-4-bromo-6-(trifluoromethyl)aniline IUPAC Name: 2-(azepan-1-ylmethyl)-4-bromo-6-(trifluoromethyl)aniline Traditional Name: [2-(azepan-1-ylmethyl)-4-bromo-6-(trifluoromethyl)phenyl]amine Formula: C14H18BrF3N2 MolecularWeight: 351.20533

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC(=CC(=C2N)C(F)(F)F)Br

Isomeric SMILES

C1CCCN(CC1)CC2=CC(=CC(=C2N)C(F)(F)F)Br

InChI

InChI=1S/C14H18BrF3N2/c15-11-7-10(9-20-5-3-1-2-4-6-20)13(19)12(8-11)14(16,17)18/h7-8H,1-6,9,19H2