2-[1-(4-fluorophenyl)pyrrol-3-yl]-4-oxidanylidene-4-phenylmethoxy-butanoic acid

Systemtic Name: 2-[1-(4-fluorophenyl)pyrrol-3-yl]-4-oxidanylidene-4-phenylmethoxy-butanoic acid Openeye Name: 4-benzyloxy-2-[1-(4-fluorophenyl)pyrrol-3-yl]-4-oxo-butanoic acid CAS Name: 2-[1-(4-fluorophenyl)-3-pyrrolyl]-4-oxo-4-phenylmethoxybutanoic acid IUPAC Name: 2-[1-(4-fluorophenyl)pyrrol-3-yl]-4-oxo-4-phenylmethoxybutanoic acid Traditional Name: 4-benzoxy-2-[1-(4-fluorophenyl)pyrrol-3-yl]-4-keto-butyric acid Formula: C21H18FNO4 MolecularWeight: 367.370323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CC(C2=CN(C=C2)C3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CC(C2=CN(C=C2)C3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C21H18FNO4/c22-17-6-8-18(9-7-17)23-11-10-16(13-23)19(21(25)26)12-20(24)27-14-15-4-2-1-3-5-15/h1-11,13,19H,12,14H2,(H,25,26)