4-[3-[2-chloranyl-5-(trifluoromethyl)phenyl]-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid

Systemtic Name: 4-[3-[2-chloranyl-5-(trifluoromethyl)phenyl]-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid Openeye Name: 4-[3-[2-chloro-5-(trifluoromethyl)phenyl]-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid CAS Name: 4-[3-[2-chloro-5-(trifluoromethyl)phenyl]-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid IUPAC Name: 4-[3-[2-chloro-5-(trifluoromethyl)phenyl]-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid Traditional Name: 4-[3-[2-chloro-5-(trifluoromethyl)phenyl]-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid Formula: C19H13ClF3N3O2 MolecularWeight: 407.77363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C2C1=C(NN2C3=CC=C(C=C3)C(=O)O)C4=C(C=CC(=C4)C(F)(F)F)Cl

Isomeric SMILES

C1CN=C2C1=C(NN2C3=CC=C(C=C3)C(=O)O)C4=C(C=CC(=C4)C(F)(F)F)Cl

InChI

InChI=1S/C19H13ClF3N3O2/c20-15-6-3-11(19(21,22)23)9-14(15)16-13-7-8-24-17(13)26(25-16)12-4-1-10(2-5-12)18(27)28/h1-6,9,25H,7-8H2,(H,27,28)