1-[4-[4-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-(2-bromo-4,5-dimethoxy-phenyl)sulfonylpiperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-(2-bromo-4,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(2-bromo-4,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(2-bromo-4,5-dimethoxy-phenyl)sulfonylpiperazino]phenyl]ethanone Formula: C20H23BrN2O5S MolecularWeight: 483.37602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C(=C3)OC)OC)Br

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C(=C3)OC)OC)Br

InChI

InChI=1S/C20H23BrN2O5S/c1-14(24)15-4-6-16(7-5-15)22-8-10-23(11-9-22)29(25,26)20-13-19(28-3)18(27-2)12-17(20)21/h4-7,12-13H,8-11H2,1-3H3