4-[2-(ethylamino)-2-oxidanylidene-ethoxy]-5-methoxy-2-nitro-benzoic acid

Systemtic Name: 4-[2-(ethylamino)-2-oxidanylidene-ethoxy]-5-methoxy-2-nitro-benzoic acid Openeye Name: 4-[2-(ethylamino)-2-oxo-ethoxy]-5-methoxy-2-nitro-benzoic acid CAS Name: 4-[2-(ethylamino)-2-oxoethoxy]-5-methoxy-2-nitrobenzoic acid IUPAC Name: 4-[2-(ethylamino)-2-oxoethoxy]-5-methoxy-2-nitrobenzoic acid Traditional Name: 4-[2-(ethylamino)-2-keto-ethoxy]-5-methoxy-2-nitro-benzoic acid Formula: C12H14N2O7 MolecularWeight: 298.24876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O7/c1-3-13-11(15)6-21-10-5-8(14(18)19)7(12(16)17)4-9(10)20-2/h4-5H,3,6H2,1-2H3,(H,13,15)(H,16,17)