2,4-bis(bromanyl)-6-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]phenol

Systemtic Name: 2,4-bis(bromanyl)-6-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]phenol Openeye Name: 2,4-dibromo-6-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]phenol CAS Name: 2,4-dibromo-6-[[4-(2,5-dimethylphenyl)-1-piperazin-1-iumyl]methyl]phenol IUPAC Name: 2,4-dibromo-6-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]phenol Traditional Name: 2,4-dibromo-6-[[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]methyl]phenol Formula: C19H23Br2N2O+ MolecularWeight: 455.20672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC3=CC(=CC(=C3O)Br)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC3=CC(=CC(=C3O)Br)Br

InChI

InChI=1S/C19H22Br2N2O/c1-13-3-4-14(2)18(9-13)23-7-5-22(6-8-23)12-15-10-16(20)11-17(21)19(15)24/h3-4,9-11,24H,5-8,12H2,1-2H3/p+1