2-[6-[butanoyl(cyclohexyl)amino]oxy-2-methanoyl-3-nitro-phenyl]ethyl ethanoate

Systemtic Name: 2-[6-[butanoyl(cyclohexyl)amino]oxy-2-methanoyl-3-nitro-phenyl]ethyl ethanoate Openeye Name: 2-[6-[butanoyl(cyclohexyl)amino]oxy-2-formyl-3-nitro-phenyl]ethyl acetate CAS Name: acetic acid 2-[6-[cyclohexyl(1-oxobutyl)amino]oxy-2-formyl-3-nitrophenyl]ethyl ester IUPAC Name: 2-[6-[butanoyl(cyclohexyl)amino]oxy-2-formyl-3-nitrophenyl]ethyl acetate Traditional Name: acetic acid 2-[6-[butyryl(cyclohexyl)amino]oxy-2-formyl-3-nitro-phenyl]ethyl ester Formula: C21H28N2O7 MolecularWeight: 420.45622

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1CCCCC1)OC2=C(C(=C(C=C2)[N+](=O)[O-])C=O)CCOC(=O)C

Isomeric SMILES

CCCC(=O)N(C1CCCCC1)OC2=C(C(=C(C=C2)[N+](=O)[O-])C=O)CCOC(=O)C

InChI

InChI=1S/C21H28N2O7/c1-3-7-21(26)22(16-8-5-4-6-9-16)30-20-11-10-19(23(27)28)18(14-24)17(20)12-13-29-15(2)25/h10-11,14,16H,3-9,12-13H2,1-2H3