2-(6-nitro-4-phenyl-2,3-dihydro-1,4-benzoxazin-2-yl)ethanoate

Systemtic Name: 2-(6-nitro-4-phenyl-2,3-dihydro-1,4-benzoxazin-2-yl)ethanoate Openeye Name: 2-(6-nitro-4-phenyl-2,3-dihydro-1,4-benzoxazin-2-yl)acetate CAS Name: 2-(6-nitro-4-phenyl-2,3-dihydro-1,4-benzoxazin-2-yl)acetate IUPAC Name: 2-(6-nitro-4-phenyl-2,3-dihydro-1,4-benzoxazin-2-yl)acetate Traditional Name: 2-(6-nitro-4-phenyl-2,3-dihydro-1,4-benzoxazin-2-yl)acetate Formula: C16H13N2O5- MolecularWeight: 313.28482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(N1C3=CC=CC=C3)C=C(C=C2)[N+](=O)[O-])CC(=O)[O-]

Isomeric SMILES

C1C(OC2=C(N1C3=CC=CC=C3)C=C(C=C2)[N+](=O)[O-])CC(=O)[O-]

InChI

InChI=1S/C16H14N2O5/c19-16(20)9-13-10-17(11-4-2-1-3-5-11)14-8-12(18(21)22)6-7-15(14)23-13/h1-8,13H,9-10H2,(H,19,20)/p-1