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

Systemtic Name: potassium ethyl 3-(3-methoxy-4-methyl-2,6-dinitro-phenyl)-2-oxidanylidene-propanoate Openeye Name: potassium ethyl 3-(3-methoxy-4-methyl-2,6-dinitro-phenyl)-2-oxo-propanoate CAS Name: potassium 3-(3-methoxy-4-methyl-2,6-dinitrophenyl)-2-oxopropanoic acid ethyl ester IUPAC Name: potassium ethyl 3-(3-methoxy-4-methyl-2,6-dinitrophenyl)-2-oxopropanoate Traditional Name: potassium 2-keto-3-(3-methoxy-4-methyl-2,6-dinitro-phenyl)propionic acid ethyl ester Formula: C13H13KN2O8 MolecularWeight: 364.34922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)[CH-]C1=C(C=C(C(=C1[N+](=O)[O-])OC)C)[N+](=O)[O-].[K+]

Isomeric SMILES

CCOC(=O)C(=O)[CH-]C1=C(C=C(C(=C1[N+](=O)[O-])OC)C)[N+](=O)[O-].[K+]

InChI

InChI=1S/C13H13N2O8.K/c1-4-23-13(17)10(16)6-8-9(14(18)19)5-7(2)12(22-3)11(8)15(20)21;/h5-6H,4H2,1-3H3;/q-1;+1