5-[3,4-bis(fluoranyl)phenoxy]-8-nitro-isoquinoline

Systemtic Name: 5-[3,4-bis(fluoranyl)phenoxy]-8-nitro-isoquinoline Openeye Name: 5-(3,4-difluorophenoxy)-8-nitro-isoquinoline CAS Name: 5-(3,4-difluorophenoxy)-8-nitroisoquinoline IUPAC Name: 5-(3,4-difluorophenoxy)-8-nitroisoquinoline Traditional Name: 5-(3,4-difluorophenoxy)-8-nitro-isoquinoline Formula: C15H8F2N2O3 MolecularWeight: 302.232426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-])F)F

Isomeric SMILES

C1=CC(=C(C=C1OC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-])F)F

InChI

InChI=1S/C15H8F2N2O3/c16-12-2-1-9(7-13(12)17)22-15-4-3-14(19(20)21)11-8-18-6-5-10(11)15/h1-8H