5-ethoxy-1-(4-methyl-3-nitro-phenyl)pentane-1,3-dione

Systemtic Name: 5-ethoxy-1-(4-methyl-3-nitro-phenyl)pentane-1,3-dione Openeye Name: 5-ethoxy-1-(4-methyl-3-nitro-phenyl)pentane-1,3-dione CAS Name: 5-ethoxy-1-(4-methyl-3-nitrophenyl)pentane-1,3-dione IUPAC Name: 5-ethoxy-1-(4-methyl-3-nitrophenyl)pentane-1,3-dione Traditional Name: 5-ethoxy-1-(4-methyl-3-nitro-phenyl)pentane-1,3-dione Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO5/c1-3-20-7-6-12(16)9-14(17)11-5-4-10(2)13(8-11)15(18)19/h4-5,8H,3,6-7,9H2,1-2H3