2-fluoranyl-5-[2-(4-methoxy-3-nitro-phenyl)-1,3-benzoxazol-5-yl]benzaldehyde

Systemtic Name: 2-fluoranyl-5-[2-(4-methoxy-3-nitro-phenyl)-1,3-benzoxazol-5-yl]benzaldehyde Openeye Name: 2-fluoro-5-[2-(4-methoxy-3-nitro-phenyl)-1,3-benzoxazol-5-yl]benzaldehyde CAS Name: 2-fluoro-5-[2-(4-methoxy-3-nitrophenyl)-1,3-benzoxazol-5-yl]benzaldehyde IUPAC Name: 2-fluoro-5-[2-(4-methoxy-3-nitrophenyl)-1,3-benzoxazol-5-yl]benzaldehyde Traditional Name: 2-fluoro-5-[2-(4-methoxy-3-nitro-phenyl)-1,3-benzoxazol-5-yl]benzaldehyde Formula: C21H13FN2O5 MolecularWeight: 392.336723

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C4=CC(=C(C=C4)F)C=O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C4=CC(=C(C=C4)F)C=O)[N+](=O)[O-]

InChI

InChI=1S/C21H13FN2O5/c1-28-20-7-4-14(10-18(20)24(26)27)21-23-17-9-13(3-6-19(17)29-21)12-2-5-16(22)15(8-12)11-25/h2-11H,1H3