5-ethoxy-2-methyl-1-(3-nitrophenyl)pentane-1,3-dione

Systemtic Name: 5-ethoxy-2-methyl-1-(3-nitrophenyl)pentane-1,3-dione Openeye Name: 5-ethoxy-2-methyl-1-(3-nitrophenyl)pentane-1,3-dione CAS Name: 5-ethoxy-2-methyl-1-(3-nitrophenyl)pentane-1,3-dione IUPAC Name: 5-ethoxy-2-methyl-1-(3-nitrophenyl)pentane-1,3-dione Traditional Name: 5-ethoxy-2-methyl-1-(3-nitrophenyl)pentane-1,3-dione Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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