1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-4-methyl-pentan-1-one

Systemtic Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-4-methyl-pentan-1-one Openeye Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-4-methyl-pentan-1-one CAS Name: 1-[4-(3-bromophenyl)sulfonyl-1-piperazinyl]-4-methyl-1-pentanone IUPAC Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-4-methylpentan-1-one Traditional Name: 1-[4-(3-bromophenyl)sulfonylpiperazino]-4-methyl-pentan-1-one Formula: C16H23BrN2O3S MolecularWeight: 403.33442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CC(C)CCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C16H23BrN2O3S/c1-13(2)6-7-16(20)18-8-10-19(11-9-18)23(21,22)15-5-3-4-14(17)12-15/h3-5,12-13H,6-11H2,1-2H3