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

Systemtic Name: 8-[3-[3,4-bis(fluoranyl)phenyl]propyl]-10H-phenoxazine-1-carboxylic acid Openeye Name: 8-[3-(3,4-difluorophenyl)propyl]-10H-phenoxazine-1-carboxylic acid CAS Name: 8-[3-(3,4-difluorophenyl)propyl]-10H-phenoxazine-1-carboxylic acid IUPAC Name: 8-[3-(3,4-difluorophenyl)propyl]-10H-phenoxazine-1-carboxylic acid Traditional Name: 8-[3-(3,4-difluorophenyl)propyl]-10H-phenoxazine-1-carboxylic acid Formula: C22H17F2NO3 MolecularWeight: 381.372086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)OC3=C(N2)C=C(C=C3)CCCC4=CC(=C(C=C4)F)F)C(=O)O

Isomeric SMILES

C1=CC(=C2C(=C1)OC3=C(N2)C=C(C=C3)CCCC4=CC(=C(C=C4)F)F)C(=O)O

InChI

InChI=1S/C22H17F2NO3/c23-16-9-7-13(11-17(16)24)3-1-4-14-8-10-19-18(12-14)25-21-15(22(26)27)5-2-6-20(21)28-19/h2,5-12,25H,1,3-4H2,(H,26,27)