2-[2-(hydroxymethyl)-4-nitro-phenoxy]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2-(hydroxymethyl)-4-nitro-phenoxy]-N-propan-2-yl-ethanamide Openeye Name: 2-[2-(hydroxymethyl)-4-nitro-phenoxy]-N-isopropyl-acetamide CAS Name: 2-[2-(hydroxymethyl)-4-nitrophenoxy]-N-propan-2-ylacetamide IUPAC Name: 2-[2-(hydroxymethyl)-4-nitrophenoxy]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-(2-methylol-4-nitro-phenoxy)acetamide Formula: C12H16N2O5 MolecularWeight: 268.26584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)COC1=C(C=C(C=C1)[N+](=O)[O-])CO

Isomeric SMILES

CC(C)NC(=O)COC1=C(C=C(C=C1)[N+](=O)[O-])CO

InChI

InChI=1S/C12H16N2O5/c1-8(2)13-12(16)7-19-11-4-3-10(14(17)18)5-9(11)6-15/h3-5,8,15H,6-7H2,1-2H3,(H,13,16)