2-chloranyl-4-(4-fluorophenyl)-1-methoxy-benzene; 2-methylsulfonylcyclopenta-1,3-diene

Systemtic Name: 2-chloranyl-4-(4-fluorophenyl)-1-methoxy-benzene; 2-methylsulfonylcyclopenta-1,3-diene Openeye Name: 2-chloro-4-(4-fluorophenyl)-1-methoxy-benzene; 2-methylsulfonylcyclopenta-1,3-diene CAS Name: 2-chloro-4-(4-fluorophenyl)-1-methoxybenzene; 2-methylsulfonylcyclopenta-1,3-diene IUPAC Name: 2-chloro-4-(4-fluorophenyl)-1-methoxybenzene; 2-methylsulfonylcyclopenta-1,3-diene Traditional Name: 2-chloro-4-(4-fluorophenyl)-1-methoxy-benzene; 2-mesylcyclopenta-1,3-diene Formula: C19H18ClFO3S MolecularWeight: 380.860823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC=C(C=C2)F)Cl.CS(=O)(=O)C1=CCC=C1

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC=C(C=C2)F)Cl.CS(=O)(=O)C1=CCC=C1

InChI

InChI=1S/C13H10ClFO.C6H8O2S/c1-16-13-7-4-10(8-12(13)14)9-2-5-11(15)6-3-9;1-9(7,8)6-4-2-3-5-6/h2-8H,1H3;2,4-5H,3H2,1H3