1-(3-nitro-4-octoxy-phenyl)ethanone

Systemtic Name: 1-(3-nitro-4-octoxy-phenyl)ethanone Openeye Name: 1-(3-nitro-4-octoxy-phenyl)ethanone CAS Name: 1-(3-nitro-4-octoxyphenyl)ethanone IUPAC Name: 1-(3-nitro-4-octoxyphenyl)ethanone Traditional Name: 1-(3-nitro-4-octoxy-phenyl)ethanone Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C16H23NO4/c1-3-4-5-6-7-8-11-21-16-10-9-14(13(2)18)12-15(16)17(19)20/h9-10,12H,3-8,11H2,1-2H3