1-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[(5-bromo-2,4-dimethoxy-phenyl)methyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[(5-bromo-2,4-dimethoxyphenyl)methyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-(5-bromo-2,4-dimethoxy-benzyl)-4-methyl-piperazine-1,4-diium Formula: C14H23BrN2O2+2 MolecularWeight: 331.24862

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC2=CC(=C(C=C2OC)OC)Br

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC2=CC(=C(C=C2OC)OC)Br

InChI

InChI=1S/C14H21BrN2O2/c1-16-4-6-17(7-5-16)10-11-8-12(15)14(19-3)9-13(11)18-2/h8-9H,4-7,10H2,1-3H3/p+2