1-bromanyl-4-(4-fluorophenyl)-2-methyl-benzene; 2-methylsulfonylcyclopenta-1,3-diene

Systemtic Name: 1-bromanyl-4-(4-fluorophenyl)-2-methyl-benzene; 2-methylsulfonylcyclopenta-1,3-diene Openeye Name: 1-bromo-4-(4-fluorophenyl)-2-methyl-benzene; 2-methylsulfonylcyclopenta-1,3-diene CAS Name: 1-bromo-4-(4-fluorophenyl)-2-methylbenzene; 2-methylsulfonylcyclopenta-1,3-diene IUPAC Name: 1-bromo-4-(4-fluorophenyl)-2-methylbenzene; 2-methylsulfonylcyclopenta-1,3-diene Traditional Name: 1-bromo-4-(4-fluorophenyl)-2-methyl-benzene; 2-mesylcyclopenta-1,3-diene Formula: C19H18BrFO2S MolecularWeight: 409.312423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC=C(C=C2)F)Br.CS(=O)(=O)C1=CCC=C1

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC=C(C=C2)F)Br.CS(=O)(=O)C1=CCC=C1

InChI

InChI=1S/C13H10BrF.C6H8O2S/c1-9-8-11(4-7-13(9)14)10-2-5-12(15)6-3-10;1-9(7,8)6-4-2-3-5-6/h2-8H,1H3;2,4-5H,3H2,1H3