6-nitro-N-(4-phenoxyphenyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 6-nitro-N-(4-phenoxyphenyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: 6-nitro-N-(4-phenoxyphenyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 6-nitro-N-(4-phenoxyphenyl)-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: 6-nitro-N-(4-phenoxyphenyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: 6-nitro-N-(4-phenoxyphenyl)-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C21H16N2O6 MolecularWeight: 392.36154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C21H16N2O6/c24-21(17-12-19-20(28-11-10-27-19)13-18(17)23(25)26)22-14-6-8-16(9-7-14)29-15-4-2-1-3-5-15/h1-9,12-13H,10-11H2,(H,22,24)