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

Systemtic Name: 3-butyl-4-[(4-fluorophenyl)methylamino]cyclobut-3-ene-1,2-dione Openeye Name: 3-butyl-4-[(4-fluorophenyl)methylamino]cyclobut-3-ene-1,2-dione CAS Name: 3-butyl-4-[(4-fluorophenyl)methylamino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-butyl-4-[(4-fluorophenyl)methylamino]cyclobut-3-ene-1,2-dione Traditional Name: 3-butyl-4-[(4-fluorobenzyl)amino]cyclobut-3-ene-1,2-quinone Formula: C15H16FNO2 MolecularWeight: 261.291443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)C1=O)NCC2=CC=C(C=C2)F

Isomeric SMILES

CCCCC1=C(C(=O)C1=O)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C15H16FNO2/c1-2-3-4-12-13(15(19)14(12)18)17-9-10-5-7-11(16)8-6-10/h5-8,17H,2-4,9H2,1H3