3-(tert-butylamino)-4-[(3-fluorophenyl)methylamino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(tert-butylamino)-4-[(3-fluorophenyl)methylamino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(tert-butylamino)-4-[(3-fluorophenyl)methylamino]cyclobut-3-ene-1,2-dione CAS Name: 3-(tert-butylamino)-4-[(3-fluorophenyl)methylamino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-(tert-butylamino)-4-[(3-fluorophenyl)methylamino]cyclobut-3-ene-1,2-dione Traditional Name: 3-(tert-butylamino)-4-[(3-fluorobenzyl)amino]cyclobut-3-ene-1,2-quinone Formula: C15H17FN2O2 MolecularWeight: 276.306083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17FN2O2/c1-15(2,3)18-12-11(13(19)14(12)20)17-8-9-5-4-6-10(16)7-9/h4-7,17-18H,8H2,1-3H3