2-[4-[(E)-3-(3-nitro-4-oxidanidyl-phenyl)prop-2-enoyl]phenoxy]ethanoate

Systemtic Name: 2-[4-[(E)-3-(3-nitro-4-oxidanidyl-phenyl)prop-2-enoyl]phenoxy]ethanoate Openeye Name: 2-[4-[(E)-3-(3-nitro-4-oxido-phenyl)prop-2-enoyl]phenoxy]acetate CAS Name: 2-[4-[(E)-3-(3-nitro-4-oxidophenyl)-1-oxoprop-2-enyl]phenoxy]acetate IUPAC Name: 2-[4-[(E)-3-(3-nitro-4-oxidophenyl)prop-2-enoyl]phenoxy]acetate Traditional Name: 2-[4-[(E)-3-(3-nitro-4-oxido-phenyl)acryloyl]phenoxy]acetate Formula: C17H11NO7-2 MolecularWeight: 341.27174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C=CC2=CC(=C(C=C2)[O-])[N+](=O)[O-])OCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)/C=C/C2=CC(=C(C=C2)[O-])[N+](=O)[O-])OCC(=O)[O-]

InChI

InChI=1S/C17H13NO7/c19-15(12-3-5-13(6-4-12)25-10-17(21)22)7-1-11-2-8-16(20)14(9-11)18(23)24/h1-9,20H,10H2,(H,21,22)/p-2/b7-1+