1-[[3-[(4-bromanylphenoxy)methyl]-4-methoxy-phenyl]methyl]piperazin-4-ium

Systemtic Name: 1-[[3-[(4-bromanylphenoxy)methyl]-4-methoxy-phenyl]methyl]piperazin-4-ium Openeye Name: 1-[[3-[(4-bromophenoxy)methyl]-4-methoxy-phenyl]methyl]piperazin-4-ium CAS Name: 1-[[3-[(4-bromophenoxy)methyl]-4-methoxyphenyl]methyl]piperazin-4-ium IUPAC Name: 1-[[3-[(4-bromophenoxy)methyl]-4-methoxyphenyl]methyl]piperazin-4-ium Traditional Name: 1-[3-[(4-bromophenoxy)methyl]-4-methoxy-benzyl]piperazin-4-ium Formula: C19H24BrN2O2+ MolecularWeight: 392.31006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CC[NH2+]CC2)COC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CC[NH2+]CC2)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H23BrN2O2/c1-23-19-7-2-15(13-22-10-8-21-9-11-22)12-16(19)14-24-18-5-3-17(20)4-6-18/h2-7,12,21H,8-11,13-14H2,1H3/p+1