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

Systemtic Name: 1-[(3-bromanyl-4-methoxy-phenyl)methyl]-4-[(4-chlorophenyl)methyl]piperazin-4-ium Openeye Name: 1-[(3-bromo-4-methoxy-phenyl)methyl]-4-[(4-chlorophenyl)methyl]piperazin-4-ium CAS Name: 1-[(3-bromo-4-methoxyphenyl)methyl]-4-[(4-chlorophenyl)methyl]piperazin-4-ium IUPAC Name: 1-[(3-bromo-4-methoxyphenyl)methyl]-4-[(4-chlorophenyl)methyl]piperazin-4-ium Traditional Name: 1-(3-bromo-4-methoxy-benzyl)-4-(4-chlorobenzyl)piperazin-4-ium Formula: C19H23BrClN2O+ MolecularWeight: 410.75572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)Br

InChI

InChI=1S/C19H22BrClN2O/c1-24-19-7-4-16(12-18(19)20)14-23-10-8-22(9-11-23)13-15-2-5-17(21)6-3-15/h2-7,12H,8-11,13-14H2,1H3/p+1