N-[5-(2-ethoxy-2-oxidanylidene-ethyl)-1,3,4-thiadiazol-2-yl]-4-nitro-benzenecarboximidate

Systemtic Name: N-[5-(2-ethoxy-2-oxidanylidene-ethyl)-1,3,4-thiadiazol-2-yl]-4-nitro-benzenecarboximidate Openeye Name: N-[5-(2-ethoxy-2-oxo-ethyl)-1,3,4-thiadiazol-2-yl]-4-nitro-benzenecarboximidate CAS Name: N-[5-(2-ethoxy-2-oxoethyl)-1,3,4-thiadiazol-2-yl]-4-nitrobenzenecarboximidate IUPAC Name: N-[5-(2-ethoxy-2-oxoethyl)-1,3,4-thiadiazol-2-yl]-4-nitrobenzenecarboximidate Traditional Name: N-[5-(2-ethoxy-2-keto-ethyl)-1,3,4-thiadiazol-2-yl]-4-nitro-benzenecarboximidate Formula: C13H11N4O5S- MolecularWeight: 335.31524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN=C(S1)N=C(C2=CC=C(C=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CCOC(=O)CC1=NN=C(S1)N=C(C2=CC=C(C=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C13H12N4O5S/c1-2-22-11(18)7-10-15-16-13(23-10)14-12(19)8-3-5-9(6-4-8)17(20)21/h3-6H,2,7H2,1H3,(H,14,16,19)/p-1