2-butyl-3-[(4-fluorophenyl)methylamino]-4-oxidanyl-cyclobut-2-en-1-one

Systemtic Name: 2-butyl-3-[(4-fluorophenyl)methylamino]-4-oxidanyl-cyclobut-2-en-1-one Openeye Name: 2-butyl-3-[(4-fluorophenyl)methylamino]-4-hydroxy-cyclobut-2-en-1-one CAS Name: 2-butyl-3-[(4-fluorophenyl)methylamino]-4-hydroxy-1-cyclobut-2-enone IUPAC Name: 2-butyl-3-[(4-fluorophenyl)methylamino]-4-hydroxycyclobut-2-en-1-one Traditional Name: 2-butyl-3-[(4-fluorobenzyl)amino]-4-hydroxy-cyclobut-2-en-1-one Formula: C15H18FNO2 MolecularWeight: 263.307323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18FNO2/c1-2-3-4-12-13(15(19)14(12)18)17-9-10-5-7-11(16)8-6-10/h5-8,15,17,19H,2-4,9H2,1H3