(2R)-2-fluoranyl-2-(4-phenoxyphenyl)propanoic acid; (1S)-1-phenylethanamine

Systemtic Name: (2R)-2-fluoranyl-2-(4-phenoxyphenyl)propanoic acid; (1S)-1-phenylethanamine Openeye Name: (2R)-2-fluoro-2-(4-phenoxyphenyl)propanoic acid; (1S)-1-phenylethanamine CAS Name: (2R)-2-fluoro-2-(4-phenoxyphenyl)propanoic acid; (1S)-1-phenylethanamine IUPAC Name: (2R)-2-fluoro-2-(4-phenoxyphenyl)propanoic acid; (1S)-1-phenylethanamine Traditional Name: (2R)-2-fluoro-2-(4-phenoxyphenyl)propionic acid; [(1S)-1-phenylethyl]amine Formula: C23H24FNO3 MolecularWeight: 381.439963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N.CC(C1=CC=C(C=C1)OC2=CC=CC=C2)(C(=O)O)F

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N.C[C@@](C1=CC=C(C=C1)OC2=CC=CC=C2)(C(=O)O)F

InChI

InChI=1S/C15H13FO3.C8H11N/c1-15(16,14(17)18)11-7-9-13(10-8-11)19-12-5-3-2-4-6-12;1-7(9)8-5-3-2-4-6-8/h2-10H,1H3,(H,17,18);2-7H,9H2,1H3/t15-;7-/m10/s1