[3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]methyl-cyclohexyl-azanium

Systemtic Name: [3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]methyl-cyclohexyl-azanium Openeye Name: (4-benzyloxy-3,5-dibromo-phenyl)methyl-cyclohexyl-ammonium CAS Name: cyclohexyl-[(3,5-dibromo-4-phenylmethoxyphenyl)methyl]ammonium IUPAC Name: cyclohexyl-[(3,5-dibromo-4-phenylmethoxyphenyl)methyl]azanium Traditional Name: (4-benzoxy-3,5-dibromo-benzyl)-cyclohexyl-ammonium Formula: C20H24Br2NO+ MolecularWeight: 454.21866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH2+]CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)Br

Isomeric SMILES

C1CCC(CC1)[NH2+]CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)Br

InChI

InChI=1S/C20H23Br2NO/c21-18-11-16(13-23-17-9-5-2-6-10-17)12-19(22)20(18)24-14-15-7-3-1-4-8-15/h1,3-4,7-8,11-12,17,23H,2,5-6,9-10,13-14H2/p+1