2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-fluoranyl-2-methyl-propanoic acid

Systemtic Name: 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-fluoranyl-2-methyl-propanoic acid Openeye Name: 2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]-3-fluoro-2-methyl-propanoic acid CAS Name: 2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]-3-fluoro-2-methylpropanoic acid IUPAC Name: 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-fluoro-2-methylpropanoic acid Traditional Name: 3-fluoro-2-methyl-2-(naphthionylamino)propionic acid Formula: C16H19FN2O4S MolecularWeight: 354.396463

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Descriptors Computed from Structure

Canonical SMILES:

CC(CF)(C(=O)O)NS(=O)(=O)C1=CC=CC2=C1C=CC=C2N(C)C

Isomeric SMILES

CC(CF)(C(=O)O)NS(=O)(=O)C1=CC=CC2=C1C=CC=C2N(C)C

InChI

InChI=1S/C16H19FN2O4S/c1-16(10-17,15(20)21)18-24(22,23)14-9-5-6-11-12(14)7-4-8-13(11)19(2)3/h4-9,18H,10H2,1-3H3,(H,20,21)