3-(3-bromophenyl)-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(3-bromophenyl)-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(3-bromophenyl)-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(3-bromophenyl)-1-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-(3-bromophenyl)-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(3-bromophenyl)-1-[4-(4-methoxyphenyl)sulfonylpiperazino]propan-1-one Formula: C20H23BrN2O4S MolecularWeight: 467.37662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC(=CC=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC(=CC=C3)Br

InChI

InChI=1S/C20H23BrN2O4S/c1-27-18-6-8-19(9-7-18)28(25,26)23-13-11-22(12-14-23)20(24)10-5-16-3-2-4-17(21)15-16/h2-4,6-9,15H,5,10-14H2,1H3