3-(3,5-dimethylpyrazol-1-yl)-4-[(4-fluorophenyl)amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-4-[(4-fluorophenyl)amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-4-(4-fluoroanilino)cyclobut-3-ene-1,2-dione CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-4-(4-fluoroanilino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-4-(4-fluoroanilino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-4-(4-fluoroanilino)cyclobut-3-ene-1,2-quinone Formula: C15H12FN3O2 MolecularWeight: 285.273083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(C(=O)C2=O)NC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=NN1C2=C(C(=O)C2=O)NC3=CC=C(C=C3)F)C

InChI

InChI=1S/C15H12FN3O2/c1-8-7-9(2)19(18-8)13-12(14(20)15(13)21)17-11-5-3-10(16)4-6-11/h3-7,17H,1-2H3