4-[[2-azanyl-5-bromanyl-3-[[methyl-(4-oxidanylcyclohexyl)amino]methyl]phenyl]methyl-methyl-amino]cyclohexan-1-ol

Systemtic Name: 4-[[2-azanyl-5-bromanyl-3-[[methyl-(4-oxidanylcyclohexyl)amino]methyl]phenyl]methyl-methyl-amino]cyclohexan-1-ol Openeye Name: 4-[[2-amino-5-bromo-3-[[(4-hydroxycyclohexyl)-methyl-amino]methyl]phenyl]methyl-methyl-amino]cyclohexanol CAS Name: 4-[[2-amino-5-bromo-3-[[(4-hydroxycyclohexyl)-methylamino]methyl]phenyl]methyl-methylamino]-1-cyclohexanol IUPAC Name: 4-[[2-amino-5-bromo-3-[[(4-hydroxycyclohexyl)-methylamino]methyl]phenyl]methyl-methylamino]cyclohexan-1-ol Traditional Name: 4-[[2-amino-5-bromo-3-[[(4-hydroxycyclohexyl)-methyl-amino]methyl]benzyl]-methyl-amino]cyclohexanol Formula: C22H36BrN3O2 MolecularWeight: 454.44414

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC(=C1N)CN(C)C2CCC(CC2)O)Br)C3CCC(CC3)O

Isomeric SMILES

CN(CC1=CC(=CC(=C1N)CN(C)C2CCC(CC2)O)Br)C3CCC(CC3)O

InChI

InChI=1S/C22H36BrN3O2/c1-25(18-3-7-20(27)8-4-18)13-15-11-17(23)12-16(22(15)24)14-26(2)19-5-9-21(28)10-6-19/h11-12,18-21,27-28H,3-10,13-14,24H2,1-2H3