2-[(2-fluoranyl-5-methyl-phenyl)sulfonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[(2-fluoranyl-5-methyl-phenyl)sulfonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[(2-fluoro-5-methyl-phenyl)sulfonylamino]-4-methyl-pentanoic acid CAS Name: 2-[(2-fluoro-5-methylphenyl)sulfonylamino]-4-methylpentanoic acid IUPAC Name: 2-[(2-fluoro-5-methylphenyl)sulfonylamino]-4-methylpentanoic acid Traditional Name: 2-[(2-fluoro-5-methyl-phenyl)sulfonylamino]-4-methyl-valeric acid Formula: C13H18FNO4S MolecularWeight: 303.349723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)F)S(=O)(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)F)S(=O)(=O)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C13H18FNO4S/c1-8(2)6-11(13(16)17)15-20(18,19)12-7-9(3)4-5-10(12)14/h4-5,7-8,11,15H,6H2,1-3H3,(H,16,17)