N-[7-(4-fluorophenyl)carbonyl-2,3-dihydro-1,4-benzodioxin-6-yl]-3,5-dinitro-benzamide

Systemtic Name: N-[7-(4-fluorophenyl)carbonyl-2,3-dihydro-1,4-benzodioxin-6-yl]-3,5-dinitro-benzamide Openeye Name: N-[7-(4-fluorobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-3,5-dinitro-benzamide CAS Name: N-[7-[(4-fluorophenyl)-oxomethyl]-2,3-dihydro-1,4-benzodioxin-6-yl]-3,5-dinitrobenzamide IUPAC Name: N-[7-(4-fluorobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-3,5-dinitrobenzamide Traditional Name: N-[7-(4-fluorobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-3,5-dinitro-benzamide Formula: C22H14FN3O8 MolecularWeight: 467.360263

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H14FN3O8/c23-14-3-1-12(2-4-14)21(27)17-10-19-20(34-6-5-33-19)11-18(17)24-22(28)13-7-15(25(29)30)9-16(8-13)26(31)32/h1-4,7-11H,5-6H2,(H,24,28)