4-[[4-[(3-bromophenyl)methyl-[(3-methoxyphenyl)methyl]amino]cyclohexyl]methyl]cyclohexan-1-amine

Systemtic Name: 4-[[4-[(3-bromophenyl)methyl-[(3-methoxyphenyl)methyl]amino]cyclohexyl]methyl]cyclohexan-1-amine Openeye Name: 4-[[4-[(3-bromophenyl)methyl-[(3-methoxyphenyl)methyl]amino]cyclohexyl]methyl]cyclohexanamine CAS Name: 4-[[4-[(3-bromophenyl)methyl-[(3-methoxyphenyl)methyl]amino]cyclohexyl]methyl]-1-cyclohexanamine IUPAC Name: 4-[[4-[(3-bromophenyl)methyl-[(3-methoxyphenyl)methyl]amino]cyclohexyl]methyl]cyclohexan-1-amine Traditional Name: [4-[(4-aminocyclohexyl)methyl]cyclohexyl]-(3-bromobenzyl)-m-anisyl-amine Formula: C28H39BrN2O MolecularWeight: 499.52606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(CC2=CC(=CC=C2)Br)C3CCC(CC3)CC4CCC(CC4)N

Isomeric SMILES

COC1=CC=CC(=C1)CN(CC2=CC(=CC=C2)Br)C3CCC(CC3)CC4CCC(CC4)N

InChI

InChI=1S/C28H39BrN2O/c1-32-28-7-3-5-24(18-28)20-31(19-23-4-2-6-25(29)17-23)27-14-10-22(11-15-27)16-21-8-12-26(30)13-9-21/h2-7,17-18,21-22,26-27H,8-16,19-20,30H2,1H3