4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]butanoic acid

Systemtic Name: 4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]butanoic acid Openeye Name: 4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]butanoic acid CAS Name: 4-[(2-fluorophenyl)methyl-methylsulfonylamino]butanoic acid IUPAC Name: 4-[(2-fluorophenyl)methyl-methylsulfonylamino]butanoic acid Traditional Name: 4-[(2-fluorobenzyl)-mesyl-amino]butyric acid Formula: C12H16FNO4S MolecularWeight: 289.323143

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC(=O)O)CC1=CC=CC=C1F

Isomeric SMILES

CS(=O)(=O)N(CCCC(=O)O)CC1=CC=CC=C1F

InChI

InChI=1S/C12H16FNO4S/c1-19(17,18)14(8-4-7-12(15)16)9-10-5-2-3-6-11(10)13/h2-3,5-6H,4,7-9H2,1H3,(H,15,16)