methyl 4-nitrobenzoate; N-methyl-2-octoxy-ethanamide

Systemtic Name: methyl 4-nitrobenzoate; N-methyl-2-octoxy-ethanamide Openeye Name: methyl 4-nitrobenzoate; N-methyl-2-octoxy-acetamide CAS Name: N-methyl-2-octoxyacetamide; 4-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-nitrobenzoate; N-methyl-2-octoxyacetamide Traditional Name: N-methyl-2-octoxy-acetamide; 4-nitrobenzoic acid methyl ester Formula: C19H30N2O6 MolecularWeight: 382.4513

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H23NO2.C8H7NO4/c1-3-4-5-6-7-8-9-14-10-11(13)12-2;1-13-8(10)6-2-4-7(5-3-6)9(11)12/h3-10H2,1-2H3,(H,12,13);2-5H,1H3