3-ethoxy-4-[[2-[(2-fluorophenyl)methyl]-5-nitro-1,2,4-triazol-3-yl]oxy]benzaldehyde

Systemtic Name: 3-ethoxy-4-[[2-[(2-fluorophenyl)methyl]-5-nitro-1,2,4-triazol-3-yl]oxy]benzaldehyde Openeye Name: 3-ethoxy-4-[[2-[(2-fluorophenyl)methyl]-5-nitro-1,2,4-triazol-3-yl]oxy]benzaldehyde CAS Name: 3-ethoxy-4-[[2-[(2-fluorophenyl)methyl]-5-nitro-1,2,4-triazol-3-yl]oxy]benzaldehyde IUPAC Name: 3-ethoxy-4-[[2-[(2-fluorophenyl)methyl]-5-nitro-1,2,4-triazol-3-yl]oxy]benzaldehyde Traditional Name: 3-ethoxy-4-[[2-(2-fluorobenzyl)-5-nitro-1,2,4-triazol-3-yl]oxy]benzaldehyde Formula: C18H15FN4O5 MolecularWeight: 386.333903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=O)OC2=NC(=NN2CC3=CC=CC=C3F)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=O)OC2=NC(=NN2CC3=CC=CC=C3F)[N+](=O)[O-]

InChI

InChI=1S/C18H15FN4O5/c1-2-27-16-9-12(11-24)7-8-15(16)28-18-20-17(23(25)26)21-22(18)10-13-5-3-4-6-14(13)19/h3-9,11H,2,10H2,1H3