ethyl 3-(3-methoxy-4-methyl-2,6-dinitro-phenyl)-2-oxidanylidene-propanoate

Systemtic Name: ethyl 3-(3-methoxy-4-methyl-2,6-dinitro-phenyl)-2-oxidanylidene-propanoate Openeye Name: ethyl 3-(3-methoxy-4-methyl-2,6-dinitro-phenyl)-2-oxo-propanoate CAS Name: 3-(3-methoxy-4-methyl-2,6-dinitrophenyl)-2-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-(3-methoxy-4-methyl-2,6-dinitrophenyl)-2-oxopropanoate Traditional Name: 2-keto-3-(3-methoxy-4-methyl-2,6-dinitro-phenyl)propionic acid ethyl ester Formula: C13H14N2O8 MolecularWeight: 326.25886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(=O)CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O8/c1-4-23-13(17)10(16)6-8-9(14(18)19)5-7(2)12(22-3)11(8)15(20)21/h5H,4,6H2,1-3H3