N-[3-[2,4-bis(fluoranyl)phenoxy]-5-nitro-phenyl]-2-methyl-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[3-[2,4-bis(fluoranyl)phenoxy]-5-nitro-phenyl]-2-methyl-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-[3-(2,4-difluorophenoxy)-5-nitro-phenyl]-2-methyl-1-oxo-isoquinoline-4-carboxamide CAS Name: N-[3-(2,4-difluorophenoxy)-5-nitrophenyl]-2-methyl-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-[3-(2,4-difluorophenoxy)-5-nitrophenyl]-2-methyl-1-oxoisoquinoline-4-carboxamide Traditional Name: N-[3-(2,4-difluorophenoxy)-5-nitro-phenyl]-1-keto-2-methyl-isoquinoline-4-carboxamide Formula: C23H15F2N3O5 MolecularWeight: 451.379106

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C2C1=O)C(=O)NC3=CC(=CC(=C3)OC4=C(C=C(C=C4)F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C2=CC=CC=C2C1=O)C(=O)NC3=CC(=CC(=C3)OC4=C(C=C(C=C4)F)F)[N+](=O)[O-]

InChI

InChI=1S/C23H15F2N3O5/c1-27-12-19(17-4-2-3-5-18(17)23(27)30)22(29)26-14-9-15(28(31)32)11-16(10-14)33-21-7-6-13(24)8-20(21)25/h2-12H,1H3,(H,26,29)