2,4-bis(bromanyl)-6-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methyl]phenol

Systemtic Name: 2,4-bis(bromanyl)-6-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methyl]phenol Openeye Name: 2,4-dibromo-6-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methyl]phenol CAS Name: 2,4-dibromo-6-[[4-(4-chlorophenyl)-1-piperazin-1-iumyl]methyl]phenol IUPAC Name: 2,4-dibromo-6-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methyl]phenol Traditional Name: 2,4-dibromo-6-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methyl]phenol Formula: C17H18Br2ClN2O+ MolecularWeight: 461.59862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC(=C2O)Br)Br)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=CC(=C2O)Br)Br)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H17Br2ClN2O/c18-13-9-12(17(23)16(19)10-13)11-21-5-7-22(8-6-21)15-3-1-14(20)2-4-15/h1-4,9-10,23H,5-8,11H2/p+1