3-(3-fluorophenyl)-4,4-dimethyl-2-(4-methylsulfonylphenyl)cyclobut-2-en-1-one

Systemtic Name: 3-(3-fluorophenyl)-4,4-dimethyl-2-(4-methylsulfonylphenyl)cyclobut-2-en-1-one Openeye Name: 3-(3-fluorophenyl)-4,4-dimethyl-2-(4-methylsulfonylphenyl)cyclobut-2-en-1-one CAS Name: 3-(3-fluorophenyl)-4,4-dimethyl-2-(4-methylsulfonylphenyl)-1-cyclobut-2-enone IUPAC Name: 3-(3-fluorophenyl)-4,4-dimethyl-2-(4-methylsulfonylphenyl)cyclobut-2-en-1-one Traditional Name: 3-(3-fluorophenyl)-2-(4-mesylphenyl)-4,4-dimethyl-cyclobut-2-en-1-one Formula: C19H17FO3S MolecularWeight: 344.399883

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C1=O)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC(=CC=C3)F)C

Isomeric SMILES

CC1(C(=C(C1=O)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC(=CC=C3)F)C

InChI

InChI=1S/C19H17FO3S/c1-19(2)17(13-5-4-6-14(20)11-13)16(18(19)21)12-7-9-15(10-8-12)24(3,22)23/h4-11H,1-3H3