3-[1-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-5-phenyl-pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-5-phenyl-pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-[2-(4-fluoroanilino)-2-oxo-ethyl]-5-phenyl-pyrrol-2-yl]propanoic acid CAS Name: 3-[1-[2-(4-fluoroanilino)-2-oxoethyl]-5-phenyl-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-[2-(4-fluoroanilino)-2-oxoethyl]-5-phenylpyrrol-2-yl]propanoic acid Traditional Name: 3-[1-[2-(4-fluoroanilino)-2-keto-ethyl]-5-phenyl-pyrrol-2-yl]propionic acid Formula: C21H19FN2O3 MolecularWeight: 366.385563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(N2CC(=O)NC3=CC=C(C=C3)F)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(N2CC(=O)NC3=CC=C(C=C3)F)CCC(=O)O

InChI

InChI=1S/C21H19FN2O3/c22-16-6-8-17(9-7-16)23-20(25)14-24-18(11-13-21(26)27)10-12-19(24)15-4-2-1-3-5-15/h1-10,12H,11,13-14H2,(H,23,25)(H,26,27)