N-[[3-[(4-bromophenyl)methyl]imidazol-4-yl]methyl]-3-(2-methylphenyl)cyclohept-2-en-1-amine

Systemtic Name: N-[[3-[(4-bromophenyl)methyl]imidazol-4-yl]methyl]-3-(2-methylphenyl)cyclohept-2-en-1-amine Openeye Name: N-[[3-[(4-bromophenyl)methyl]imidazol-4-yl]methyl]-3-(o-tolyl)cyclohept-2-en-1-amine CAS Name: N-[[3-[(4-bromophenyl)methyl]-4-imidazolyl]methyl]-3-(2-methylphenyl)-1-cyclohept-2-enamine IUPAC Name: N-[[3-[(4-bromophenyl)methyl]imidazol-4-yl]methyl]-3-(2-methylphenyl)cyclohept-2-en-1-amine Traditional Name: [3-(4-bromobenzyl)imidazol-4-yl]methyl-[3-(o-tolyl)cyclohept-2-en-1-yl]amine Formula: C25H28BrN3 MolecularWeight: 450.41392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(CCCC2)NCC3=CN=CN3CC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=CC=C1C2=CC(CCCC2)NCC3=CN=CN3CC4=CC=C(C=C4)Br

InChI

InChI=1S/C25H28BrN3/c1-19-6-2-5-9-25(19)21-7-3-4-8-23(14-21)28-16-24-15-27-18-29(24)17-20-10-12-22(26)13-11-20/h2,5-6,9-15,18,23,28H,3-4,7-8,16-17H2,1H3