5-azanyl-2-(4-azanyl-3-fluoranyl-phenyl)-6,8-bis(fluoranyl)-7-hexyl-chromen-4-one

Systemtic Name: 5-azanyl-2-(4-azanyl-3-fluoranyl-phenyl)-6,8-bis(fluoranyl)-7-hexyl-chromen-4-one Openeye Name: 5-amino-2-(4-amino-3-fluoro-phenyl)-6,8-difluoro-7-hexyl-chromen-4-one CAS Name: 5-amino-2-(4-amino-3-fluorophenyl)-6,8-difluoro-7-hexyl-1-benzopyran-4-one IUPAC Name: 5-amino-2-(4-amino-3-fluorophenyl)-6,8-difluoro-7-hexylchromen-4-one Traditional Name: 5-amino-2-(4-amino-3-fluoro-phenyl)-6,8-difluoro-7-hexyl-chromone Formula: C21H21F3N2O2 MolecularWeight: 390.39885

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C2C(=O)C=C(OC2=C1F)C3=CC(=C(C=C3)N)F)N)F

Isomeric SMILES

CCCCCCC1=C(C(=C2C(=O)C=C(OC2=C1F)C3=CC(=C(C=C3)N)F)N)F

InChI

InChI=1S/C21H21F3N2O2/c1-2-3-4-5-6-12-18(23)20(26)17-15(27)10-16(28-21(17)19(12)24)11-7-8-14(25)13(22)9-11/h7-10H,2-6,25-26H2,1H3