2-butoxy-N-hex-5-enyl-ethanamide; ethyl 4-nitrobenzoate

Systemtic Name: 2-butoxy-N-hex-5-enyl-ethanamide; ethyl 4-nitrobenzoate Openeye Name: 2-butoxy-N-hex-5-enyl-acetamide; ethyl 4-nitrobenzoate CAS Name: 2-butoxy-N-hex-5-enylacetamide; 4-nitrobenzoic acid ethyl ester IUPAC Name: 2-butoxy-N-hex-5-enylacetamide; ethyl 4-nitrobenzoate Traditional Name: 2-butoxy-N-hex-5-enyl-acetamide; 4-nitrobenzoic acid ethyl ester Formula: C21H32N2O6 MolecularWeight: 408.48858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(=O)NCCCCC=C.CCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCOCC(=O)NCCCCC=C.CCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H23NO2.C9H9NO4/c1-3-5-7-8-9-13-12(14)11-15-10-6-4-2;1-2-14-9(11)7-3-5-8(6-4-7)10(12)13/h3H,1,4-11H2,2H3,(H,13,14);3-6H,2H2,1H3