2,4-bis(bromanyl)-6-[(4-methyl-1,4-diazepane-1,4-diium-1-yl)methyl]phenol

Systemtic Name: 2,4-bis(bromanyl)-6-[(4-methyl-1,4-diazepane-1,4-diium-1-yl)methyl]phenol Openeye Name: 2,4-dibromo-6-[(4-methyl-1,4-diazepane-1,4-diium-1-yl)methyl]phenol CAS Name: 2,4-dibromo-6-[(4-methyl-1,4-diazepane-1,4-diium-1-yl)methyl]phenol IUPAC Name: 2,4-dibromo-6-[(4-methyl-1,4-diazepane-1,4-diium-1-yl)methyl]phenol Traditional Name: 2,4-dibromo-6-[(4-methyl-1,4-diazepane-1,4-diium-1-yl)methyl]phenol Formula: C13H20Br2N2O+2 MolecularWeight: 380.1187

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC[NH+](CC1)CC2=CC(=CC(=C2O)Br)Br

Isomeric SMILES

C[NH+]1CCC[NH+](CC1)CC2=CC(=CC(=C2O)Br)Br

InChI

InChI=1S/C13H18Br2N2O/c1-16-3-2-4-17(6-5-16)9-10-7-11(14)8-12(15)13(10)18/h7-8,18H,2-6,9H2,1H3/p+2