2-[[5-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)-2-fluoranyl-phenyl]amino]-2-methyl-3-phenyl-propanoic acid

Systemtic Name: 2-[[5-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)-2-fluoranyl-phenyl]amino]-2-methyl-3-phenyl-propanoic acid Openeye Name: 2-[5-(2-amino-3-hydroxy-3-oxo-propyl)-2-fluoro-anilino]-2-methyl-3-phenyl-propanoic acid CAS Name: 2-[5-(2-amino-3-hydroxy-3-oxopropyl)-2-fluoroanilino]-2-methyl-3-phenylpropanoic acid IUPAC Name: 2-[5-(2-amino-3-hydroxy-3-oxopropyl)-2-fluoroanilino]-2-methyl-3-phenylpropanoic acid Traditional Name: 2-[5-(2-amino-3-hydroxy-3-keto-propyl)-2-fluoro-anilino]-2-methyl-3-phenyl-propionic acid Formula: C19H21FN2O4 MolecularWeight: 360.379443

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)(C(=O)O)NC2=C(C=CC(=C2)CC(C(=O)O)N)F

Isomeric SMILES

CC(CC1=CC=CC=C1)(C(=O)O)NC2=C(C=CC(=C2)CC(C(=O)O)N)F

InChI

InChI=1S/C19H21FN2O4/c1-19(18(25)26,11-12-5-3-2-4-6-12)22-16-10-13(7-8-14(16)20)9-15(21)17(23)24/h2-8,10,15,22H,9,11,21H2,1H3,(H,23,24)(H,25,26)