2-[2-(cyclopropylmethyl)-3-oxidanylidene-5-(trifluoromethyl)-1H-isoindol-1-yl]ethanoic acid

Systemtic Name: 2-[2-(cyclopropylmethyl)-3-oxidanylidene-5-(trifluoromethyl)-1H-isoindol-1-yl]ethanoic acid Openeye Name: 2-[2-(cyclopropylmethyl)-3-oxo-5-(trifluoromethyl)isoindolin-1-yl]acetic acid CAS Name: 2-[2-(cyclopropylmethyl)-3-oxo-5-(trifluoromethyl)-1H-isoindol-1-yl]acetic acid IUPAC Name: 2-[2-(cyclopropylmethyl)-3-oxo-5-(trifluoromethyl)-1H-isoindol-1-yl]acetic acid Traditional Name: 2-[2-(cyclopropylmethyl)-3-keto-5-(trifluoromethyl)isoindolin-1-yl]acetic acid Formula: C15H14F3NO3 MolecularWeight: 313.27177

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C(C3=C(C2=O)C=C(C=C3)C(F)(F)F)CC(=O)O

Isomeric SMILES

C1CC1CN2C(C3=C(C2=O)C=C(C=C3)C(F)(F)F)CC(=O)O

InChI

InChI=1S/C15H14F3NO3/c16-15(17,18)9-3-4-10-11(5-9)14(22)19(7-8-1-2-8)12(10)6-13(20)21/h3-5,8,12H,1-2,6-7H2,(H,20,21)