2-[(4-fluorophenyl)sulfonyl-methyl-amino]-3-methyl-butanoic acid

Systemtic Name: 2-[(4-fluorophenyl)sulfonyl-methyl-amino]-3-methyl-butanoic acid Openeye Name: 2-[(4-fluorophenyl)sulfonyl-methyl-amino]-3-methyl-butanoic acid CAS Name: 2-[(4-fluorophenyl)sulfonyl-methylamino]-3-methylbutanoic acid IUPAC Name: 2-[(4-fluorophenyl)sulfonyl-methylamino]-3-methylbutanoic acid Traditional Name: 2-[(4-fluorophenyl)sulfonyl-methyl-amino]-3-methyl-butyric acid Formula: C12H16FNO4S MolecularWeight: 289.323143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N(C)S(=O)(=O)C1=CC=C(C=C1)F

Isomeric SMILES

CC(C)C(C(=O)O)N(C)S(=O)(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C12H16FNO4S/c1-8(2)11(12(15)16)14(3)19(17,18)10-6-4-9(13)5-7-10/h4-8,11H,1-3H3,(H,15,16)