N-(4-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine bromide

Systemtic Name: N-(4-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine bromide Openeye Name: N-(p-tolyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine bromide CAS Name: N-(4-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine bromide IUPAC Name: N-(4-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine bromide Traditional Name: p-tolyl(3,4,5,6-tetrahydro-2H-azepin-7-yl)amine bromide Formula: C13H18BrN2- MolecularWeight: 282.19942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NCCCCC2.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NCCCCC2.[Br-]

InChI

InChI=1S/C13H18N2.BrH/c1-11-6-8-12(9-7-11)15-13-5-3-2-4-10-14-13;/h6-9H,2-5,10H2,1H3,(H,14,15);1H/p-1