1-[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]-3,3-dimethyl-butan-1-one

Systemtic Name: 1-[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]-3,3-dimethyl-butan-1-one Openeye Name: 1-[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazin-1-yl]-3,3-dimethyl-butan-1-one CAS Name: 1-[4-(4-bromo-2-chlorophenyl)sulfonyl-1-piperazinyl]-3,3-dimethyl-1-butanone IUPAC Name: 1-[4-(4-bromo-2-chlorophenyl)sulfonylpiperazin-1-yl]-3,3-dimethylbutan-1-one Traditional Name: 1-[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazino]-3,3-dimethyl-butan-1-one Formula: C16H22BrClN2O3S MolecularWeight: 437.77948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22BrClN2O3S/c1-16(2,3)11-15(21)19-6-8-20(9-7-19)24(22,23)14-5-4-12(17)10-13(14)18/h4-5,10H,6-9,11H2,1-3H3