1-(2-bromophenyl)sulfonyl-4-[(4-methoxyphenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(2-bromophenyl)sulfonyl-4-[(4-methoxyphenyl)methyl]piperazin-4-ium Openeye Name: 1-(2-bromophenyl)sulfonyl-4-[(4-methoxyphenyl)methyl]piperazin-4-ium CAS Name: 1-(2-bromophenyl)sulfonyl-4-[(4-methoxyphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(2-bromophenyl)sulfonyl-4-[(4-methoxyphenyl)methyl]piperazin-4-ium Traditional Name: 1-(2-bromophenyl)sulfonyl-4-p-anisyl-piperazin-4-ium Formula: C18H22BrN2O3S+ MolecularWeight: 426.34788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Br

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C18H21BrN2O3S/c1-24-16-8-6-15(7-9-16)14-20-10-12-21(13-11-20)25(22,23)18-5-3-2-4-17(18)19/h2-9H,10-14H2,1H3/p+1