1-(4-butan-2-ylphenyl)-2-(2-nitropyridin-3-yl)oxy-ethanone

Systemtic Name: 1-(4-butan-2-ylphenyl)-2-(2-nitropyridin-3-yl)oxy-ethanone Openeye Name: 2-[(2-nitro-3-pyridyl)oxy]-1-(4-sec-butylphenyl)ethanone CAS Name: 1-(4-butan-2-ylphenyl)-2-[(2-nitro-3-pyridinyl)oxy]ethanone IUPAC Name: 1-(4-butan-2-ylphenyl)-2-(2-nitropyridin-3-yl)oxyethanone Traditional Name: 2-[(2-nitro-3-pyridyl)oxy]-1-(4-sec-butylphenyl)ethanone Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(=O)COC2=C(N=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(=O)COC2=C(N=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O4/c1-3-12(2)13-6-8-14(9-7-13)15(20)11-23-16-5-4-10-18-17(16)19(21)22/h4-10,12H,3,11H2,1-2H3