3-(3-fluorophenyl)-2-[(4-methylphenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-(3-fluorophenyl)-2-[(4-methylphenyl)sulfonylamino]propanoic acid Openeye Name: 3-(3-fluorophenyl)-2-(p-tolylsulfonylamino)propanoic acid CAS Name: 3-(3-fluorophenyl)-2-[(4-methylphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-(3-fluorophenyl)-2-[(4-methylphenyl)sulfonylamino]propanoic acid Traditional Name: 3-(3-fluorophenyl)-2-(tosylamino)propionic acid Formula: C16H16FNO4S MolecularWeight: 337.365943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC(=CC=C2)F)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC(=CC=C2)F)C(=O)O

InChI

InChI=1S/C16H16FNO4S/c1-11-5-7-14(8-6-11)23(21,22)18-15(16(19)20)10-12-3-2-4-13(17)9-12/h2-9,15,18H,10H2,1H3,(H,19,20)