8-[3-[3,4-bis(fluoranyl)phenyl]propyl]-3-nitro-10H-phenoxazine-1-carboxylic acid

Systemtic Name: 8-[3-[3,4-bis(fluoranyl)phenyl]propyl]-3-nitro-10H-phenoxazine-1-carboxylic acid Openeye Name: 8-[3-(3,4-difluorophenyl)propyl]-3-nitro-10H-phenoxazine-1-carboxylic acid CAS Name: 8-[3-(3,4-difluorophenyl)propyl]-3-nitro-10H-phenoxazine-1-carboxylic acid IUPAC Name: 8-[3-(3,4-difluorophenyl)propyl]-3-nitro-10H-phenoxazine-1-carboxylic acid Traditional Name: 8-[3-(3,4-difluorophenyl)propyl]-3-nitro-10H-phenoxazine-1-carboxylic acid Formula: C22H16F2N2O5 MolecularWeight: 426.369646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CCCC3=CC(=C(C=C3)F)F)NC4=C(O2)C=C(C=C4C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1CCCC3=CC(=C(C=C3)F)F)NC4=C(O2)C=C(C=C4C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C22H16F2N2O5/c23-16-6-4-12(8-17(16)24)2-1-3-13-5-7-19-18(9-13)25-21-15(22(27)28)10-14(26(29)30)11-20(21)31-19/h4-11,25H,1-3H2,(H,27,28)