2-[4-(aminomethyl)-2-methoxy-5-nitro-phenoxy]-N-ethyl-ethanamide

Systemtic Name: 2-[4-(aminomethyl)-2-methoxy-5-nitro-phenoxy]-N-ethyl-ethanamide Openeye Name: 2-[4-(aminomethyl)-2-methoxy-5-nitro-phenoxy]-N-ethyl-acetamide CAS Name: 2-[4-(aminomethyl)-2-methoxy-5-nitrophenoxy]-N-ethylacetamide IUPAC Name: 2-[4-(aminomethyl)-2-methoxy-5-nitrophenoxy]-N-ethylacetamide Traditional Name: 2-[4-(aminomethyl)-2-methoxy-5-nitro-phenoxy]-N-ethyl-acetamide Formula: C12H17N3O5 MolecularWeight: 283.28048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O5/c1-3-14-12(16)7-20-11-5-9(15(17)18)8(6-13)4-10(11)19-2/h4-5H,3,6-7,13H2,1-2H3,(H,14,16)