3-[2-[(4-fluoranylnaphthalen-1-yl)methylcarbamoyl]-4-(phenoxymethyl)phenyl]propanoic acid

Systemtic Name: 3-[2-[(4-fluoranylnaphthalen-1-yl)methylcarbamoyl]-4-(phenoxymethyl)phenyl]propanoic acid Openeye Name: 3-[2-[(4-fluoro-1-naphthyl)methylcarbamoyl]-4-(phenoxymethyl)phenyl]propanoic acid CAS Name: 3-[2-[[(4-fluoro-1-naphthalenyl)methylamino]-oxomethyl]-4-(phenoxymethyl)phenyl]propanoic acid IUPAC Name: 3-[2-[(4-fluoronaphthalen-1-yl)methylcarbamoyl]-4-(phenoxymethyl)phenyl]propanoic acid Traditional Name: 3-[2-[(4-fluoro-1-naphthyl)methylcarbamoyl]-4-(phenoxymethyl)phenyl]propionic acid Formula: C28H24FNO4 MolecularWeight: 457.492863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=CC(=C(C=C2)CCC(=O)O)C(=O)NCC3=CC=C(C4=CC=CC=C34)F

Isomeric SMILES

C1=CC=C(C=C1)OCC2=CC(=C(C=C2)CCC(=O)O)C(=O)NCC3=CC=C(C4=CC=CC=C34)F

InChI

InChI=1S/C28H24FNO4/c29-26-14-12-21(23-8-4-5-9-24(23)26)17-30-28(33)25-16-19(10-11-20(25)13-15-27(31)32)18-34-22-6-2-1-3-7-22/h1-12,14,16H,13,15,17-18H2,(H,30,33)(H,31,32)