(4-bromophenyl) 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: (4-bromophenyl) 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: (4-bromophenyl) 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-acetylpiperazino)sulfonylbenzoic acid (4-bromophenyl) ester Formula: C19H19BrN2O5S MolecularWeight: 467.33356

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC=C(C=C3)Br

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H19BrN2O5S/c1-14(23)21-9-11-22(12-10-21)28(25,26)18-4-2-3-15(13-18)19(24)27-17-7-5-16(20)6-8-17/h2-8,13H,9-12H2,1H3