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

Systemtic Name: 1-(4-heptoxy-3-nitro-phenyl)ethanone Openeye Name: 1-(4-heptoxy-3-nitro-phenyl)ethanone CAS Name: 1-(4-heptoxy-3-nitrophenyl)ethanone IUPAC Name: 1-(4-heptoxy-3-nitrophenyl)ethanone Traditional Name: 1-(4-heptoxy-3-nitro-phenyl)ethanone Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C(C=C1)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCOC1=C(C=C(C=C1)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C15H21NO4/c1-3-4-5-6-7-10-20-15-9-8-13(12(2)17)11-14(15)16(18)19/h8-9,11H,3-7,10H2,1-2H3