2-ethyl-7-(4-nitrophenyl)-1,6,2-dioxazepane

Systemtic Name: 2-ethyl-7-(4-nitrophenyl)-1,6,2-dioxazepane Openeye Name: 2-ethyl-7-(4-nitrophenyl)-1,6,2-dioxazepane CAS Name: 2-ethyl-7-(4-nitrophenyl)-1,6,2-dioxazepane IUPAC Name: 2-ethyl-7-(4-nitrophenyl)-1,6,2-dioxazepane Traditional Name: 2-ethyl-7-(4-nitrophenyl)-1,6,2-dioxazepane Formula: C12H16N2O4 MolecularWeight: 252.26644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCOC(O1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCN1CCCOC(O1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O4/c1-2-13-8-3-9-17-12(18-13)10-4-6-11(7-5-10)14(15)16/h4-7,12H,2-3,8-9H2,1H3