1-(4-nitrophenyl)-2-octan-2-yloxy-ethanone

Systemtic Name: 1-(4-nitrophenyl)-2-octan-2-yloxy-ethanone Openeye Name: 2-(1-methylheptoxy)-1-(4-nitrophenyl)ethanone CAS Name: 1-(4-nitrophenyl)-2-octan-2-yloxyethanone IUPAC Name: 1-(4-nitrophenyl)-2-octan-2-yloxyethanone Traditional Name: 2-(1-methylheptoxy)-1-(4-nitrophenyl)ethanone Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OCC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCC(C)OCC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C16H23NO4/c1-3-4-5-6-7-13(2)21-12-16(18)14-8-10-15(11-9-14)17(19)20/h8-11,13H,3-7,12H2,1-2H3