2-[3-cyano-4-[3-cyano-5-(trifluoromethyl)phenyl]pyrrol-1-yl]ethanoic acid

Systemtic Name: 2-[3-cyano-4-[3-cyano-5-(trifluoromethyl)phenyl]pyrrol-1-yl]ethanoic acid Openeye Name: 2-[3-cyano-4-[3-cyano-5-(trifluoromethyl)phenyl]pyrrol-1-yl]acetic acid CAS Name: 2-[3-cyano-4-[3-cyano-5-(trifluoromethyl)phenyl]-1-pyrrolyl]acetic acid IUPAC Name: 2-[3-cyano-4-[3-cyano-5-(trifluoromethyl)phenyl]pyrrol-1-yl]acetic acid Traditional Name: 2-[3-cyano-4-[3-cyano-5-(trifluoromethyl)phenyl]pyrrol-1-yl]acetic acid Formula: C15H8F3N3O2 MolecularWeight: 319.23813

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C2=CN(C=C2C#N)CC(=O)O)C(F)(F)F)C#N

Isomeric SMILES

C1=C(C=C(C=C1C2=CN(C=C2C#N)CC(=O)O)C(F)(F)F)C#N

InChI

InChI=1S/C15H8F3N3O2/c16-15(17,18)12-2-9(4-19)1-10(3-12)13-7-21(8-14(22)23)6-11(13)5-20/h1-3,6-7H,8H2,(H,22,23)