3-[(4-fluorophenyl)methylamino]-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[(4-fluorophenyl)methylamino]-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-(1,1-dimethylpropylamino)-4-[(4-fluorophenyl)methylamino]cyclobut-3-ene-1,2-dione CAS Name: 3-[(4-fluorophenyl)methylamino]-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[(4-fluorophenyl)methylamino]-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(tert-amylamino)-4-[(4-fluorobenzyl)amino]cyclobut-3-ene-1,2-quinone Formula: C16H19FN2O2 MolecularWeight: 290.332663

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC1=C(C(=O)C1=O)NCC2=CC=C(C=C2)F

Isomeric SMILES

CCC(C)(C)NC1=C(C(=O)C1=O)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C16H19FN2O2/c1-4-16(2,3)19-13-12(14(20)15(13)21)18-9-10-5-7-11(17)8-6-10/h5-8,18-19H,4,9H2,1-3H3