7-[[3,4-bis(fluoranyl)phenyl]methyl]-3-nitro-10H-phenoxazine-1-carboxylic acid

Systemtic Name: 7-[[3,4-bis(fluoranyl)phenyl]methyl]-3-nitro-10H-phenoxazine-1-carboxylic acid Openeye Name: 7-[(3,4-difluorophenyl)methyl]-3-nitro-10H-phenoxazine-1-carboxylic acid CAS Name: 7-[(3,4-difluorophenyl)methyl]-3-nitro-10H-phenoxazine-1-carboxylic acid IUPAC Name: 7-[(3,4-difluorophenyl)methyl]-3-nitro-10H-phenoxazine-1-carboxylic acid Traditional Name: 7-(3,4-difluorobenzyl)-3-nitro-10H-phenoxazine-1-carboxylic acid Formula: C20H12F2N2O5 MolecularWeight: 398.316486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CC3=CC(=C(C=C3)F)F)OC4=C(N2)C(=CC(=C4)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1CC3=CC(=C(C=C3)F)F)OC4=C(N2)C(=CC(=C4)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C20H12F2N2O5/c21-14-3-1-10(6-15(14)22)5-11-2-4-16-17(7-11)29-18-9-12(24(27)28)8-13(20(25)26)19(18)23-16/h1-4,6-9,23H,5H2,(H,25,26)