1-[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 1-[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 1-[4-(4-bromo-3-methyl-phenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 1-[4-(4-bromo-3-methylphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-(4-bromo-3-methylphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 1-[4-(4-bromo-3-methyl-phenyl)sulfonylpiperazino]propan-1-one Formula: C14H19BrN2O3S MolecularWeight: 375.28126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19BrN2O3S/c1-3-14(18)16-6-8-17(9-7-16)21(19,20)12-4-5-13(15)11(2)10-12/h4-5,10H,3,6-9H2,1-2H3