2-[5-(5-cyano-1-methyl-pyrrol-2-yl)-7-fluoranyl-3,3-dimethyl-2-oxidanylidene-indol-1-yl]propanoic acid

Systemtic Name: 2-[5-(5-cyano-1-methyl-pyrrol-2-yl)-7-fluoranyl-3,3-dimethyl-2-oxidanylidene-indol-1-yl]propanoic acid Openeye Name: 2-[5-(5-cyano-1-methyl-pyrrol-2-yl)-7-fluoro-3,3-dimethyl-2-oxo-indolin-1-yl]propanoic acid CAS Name: 2-[5-(5-cyano-1-methyl-2-pyrrolyl)-7-fluoro-3,3-dimethyl-2-oxo-1-indolyl]propanoic acid IUPAC Name: 2-[5-(5-cyano-1-methylpyrrol-2-yl)-7-fluoro-3,3-dimethyl-2-oxoindol-1-yl]propanoic acid Traditional Name: 2-[5-(5-cyano-1-methyl-pyrrol-2-yl)-7-fluoro-2-keto-3,3-dimethyl-indolin-1-yl]propionic acid Formula: C19H18FN3O3 MolecularWeight: 355.362923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C2=C(C=C(C=C2F)C3=CC=C(N3C)C#N)C(C1=O)(C)C

Isomeric SMILES

CC(C(=O)O)N1C2=C(C=C(C=C2F)C3=CC=C(N3C)C#N)C(C1=O)(C)C

InChI

InChI=1S/C19H18FN3O3/c1-10(17(24)25)23-16-13(19(2,3)18(23)26)7-11(8-14(16)20)15-6-5-12(9-21)22(15)4/h5-8,10H,1-4H3,(H,24,25)