4-[2-(ethylamino)-2-oxidanylidene-ethoxy]-3-nitro-benzoic acid

Systemtic Name: 4-[2-(ethylamino)-2-oxidanylidene-ethoxy]-3-nitro-benzoic acid Openeye Name: 4-[2-(ethylamino)-2-oxo-ethoxy]-3-nitro-benzoic acid CAS Name: 4-[2-(ethylamino)-2-oxoethoxy]-3-nitrobenzoic acid IUPAC Name: 4-[2-(ethylamino)-2-oxoethoxy]-3-nitrobenzoic acid Traditional Name: 4-[2-(ethylamino)-2-keto-ethoxy]-3-nitro-benzoic acid Formula: C11H12N2O6 MolecularWeight: 268.22278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)COC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)COC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H12N2O6/c1-2-12-10(14)6-19-9-4-3-7(11(15)16)5-8(9)13(17)18/h3-5H,2,6H2,1H3,(H,12,14)(H,15,16)