1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-(2-ethoxyphenyl)propan-1-one

Systemtic Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-(2-ethoxyphenyl)propan-1-one Openeye Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-(2-ethoxyphenyl)propan-1-one CAS Name: 1-[4-(3-bromophenyl)sulfonyl-1-piperazinyl]-3-(2-ethoxyphenyl)-1-propanone IUPAC Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-3-(2-ethoxyphenyl)propan-1-one Traditional Name: 1-[4-(3-bromophenyl)sulfonylpiperazino]-3-o-phenetyl-propan-1-one Formula: C21H25BrN2O4S MolecularWeight: 481.4032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCOC1=CC=CC=C1CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H25BrN2O4S/c1-2-28-20-9-4-3-6-17(20)10-11-21(25)23-12-14-24(15-13-23)29(26,27)19-8-5-7-18(22)16-19/h3-9,16H,2,10-15H2,1H3