4-[[3,3-bis(fluoranyl)cyclobutyl]amino]-2-methyl-5-methylsulfonyl-benzoic acid

Systemtic Name: 4-[[3,3-bis(fluoranyl)cyclobutyl]amino]-2-methyl-5-methylsulfonyl-benzoic acid Openeye Name: 4-[(3,3-difluorocyclobutyl)amino]-2-methyl-5-methylsulfonyl-benzoic acid CAS Name: 4-[(3,3-difluorocyclobutyl)amino]-2-methyl-5-methylsulfonylbenzoic acid IUPAC Name: 4-[(3,3-difluorocyclobutyl)amino]-2-methyl-5-methylsulfonylbenzoic acid Traditional Name: 4-[(3,3-difluorocyclobutyl)amino]-5-mesyl-2-methyl-benzoic acid Formula: C13H15F2NO4S MolecularWeight: 319.324306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)NC2CC(C2)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)NC2CC(C2)(F)F

InChI

InChI=1S/C13H15F2NO4S/c1-7-3-10(16-8-5-13(14,15)6-8)11(21(2,19)20)4-9(7)12(17)18/h3-4,8,16H,5-6H2,1-2H3,(H,17,18)