ethyl 3-nitrobenzoate; N-methyl-2-octoxy-ethanamide

Systemtic Name: ethyl 3-nitrobenzoate; N-methyl-2-octoxy-ethanamide Openeye Name: ethyl 3-nitrobenzoate; N-methyl-2-octoxy-acetamide CAS Name: N-methyl-2-octoxyacetamide; 3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-nitrobenzoate; N-methyl-2-octoxyacetamide Traditional Name: N-methyl-2-octoxy-acetamide; 3-nitrobenzoic acid ethyl ester Formula: C20H32N2O6 MolecularWeight: 396.47788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(=O)NC.CCOC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCOCC(=O)NC.CCOC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H23NO2.C9H9NO4/c1-3-4-5-6-7-8-9-14-10-11(13)12-2;1-2-14-9(11)7-4-3-5-8(6-7)10(12)13/h3-10H2,1-2H3,(H,12,13);3-6H,2H2,1H3