1-[bis(fluoranyl)methyl]-4,5-dimethyl-2-(phenylmethyl)sulfonyl-cyclohexa-1,4-diene

Systemtic Name: 1-[bis(fluoranyl)methyl]-4,5-dimethyl-2-(phenylmethyl)sulfonyl-cyclohexa-1,4-diene Openeye Name: 1-benzylsulfonyl-2-(difluoromethyl)-4,5-dimethyl-cyclohexa-1,4-diene CAS Name: 1-(difluoromethyl)-4,5-dimethyl-2-(phenylmethyl)sulfonylcyclohexa-1,4-diene IUPAC Name: 1-benzylsulfonyl-2-(difluoromethyl)-4,5-dimethylcyclohexa-1,4-diene Traditional Name: 1-benzylsulfonyl-2-(difluoromethyl)-4,5-dimethyl-cyclohexa-1,4-diene Formula: C16H18F2O2S MolecularWeight: 312.374726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=C(C1)C(F)F)S(=O)(=O)CC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(CC(=C(C1)C(F)F)S(=O)(=O)CC2=CC=CC=C2)C

InChI

InChI=1S/C16H18F2O2S/c1-11-8-14(16(17)18)15(9-12(11)2)21(19,20)10-13-6-4-3-5-7-13/h3-7,16H,8-10H2,1-2H3