N-(2,4-dinitrophenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-amine

Systemtic Name: N-(2,4-dinitrophenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Openeye Name: N-(2,4-dinitrophenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-amine CAS Name: N-(2,4-dinitrophenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-amine IUPAC Name: N-(2,4-dinitrophenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2,4-dinitrophenyl)amine Formula: C15H13N3O6 MolecularWeight: 331.28022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])OC1

InChI

InChI=1S/C15H13N3O6/c19-17(20)11-3-4-12(13(9-11)18(21)22)16-10-2-5-14-15(8-10)24-7-1-6-23-14/h2-5,8-9,16H,1,6-7H2