(2R)-2-[[4-(6-fluoranylhex-1-ynyl)phenyl]sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: (2R)-2-[[4-(6-fluoranylhex-1-ynyl)phenyl]sulfonylamino]-3-methyl-butanoic acid Openeye Name: (2R)-2-[[4-(6-fluoranylhex-1-ynyl)phenyl]sulfonylamino]-3-methyl-butanoic acid CAS Name: (2R)-2-[[4-(6-fluoranylhex-1-ynyl)phenyl]sulfonylamino]-3-methylbutanoic acid IUPAC Name: (2R)-2-[[4-(6-fluoranylhex-1-ynyl)phenyl]sulfonylamino]-3-methylbutanoic acid Traditional Name: (2R)-2-[[4-(6-fluoranylhex-1-ynyl)phenyl]sulfonylamino]-3-methyl-butyric acid Formula: C17H22FNO4S MolecularWeight: 354.426818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C#CCCCCF

Isomeric SMILES

CC(C)[C@H](C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C#CCCCC[18F]

InChI

InChI=1S/C17H22FNO4S/c1-13(2)16(17(20)21)19-24(22,23)15-10-8-14(9-11-15)7-5-3-4-6-12-18/h8-11,13,16,19H,3-4,6,12H2,1-2H3,(H,20,21)/t16-/m1/s1/i18-1