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

Systemtic Name: 2-decoxy-N-methyl-ethanamide; methyl 4-nitrobenzoate Openeye Name: 2-decoxy-N-methyl-acetamide; methyl 4-nitrobenzoate CAS Name: 2-decoxy-N-methylacetamide; 4-nitrobenzoic acid methyl ester IUPAC Name: 2-decoxy-N-methylacetamide; methyl 4-nitrobenzoate Traditional Name: 2-decoxy-N-methyl-acetamide; 4-nitrobenzoic acid methyl ester Formula: C21H34N2O6 MolecularWeight: 410.50446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H27NO2.C8H7NO4/c1-3-4-5-6-7-8-9-10-11-16-12-13(15)14-2;1-13-8(10)6-2-4-7(5-3-6)9(11)12/h3-12H2,1-2H3,(H,14,15);2-5H,1H3