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

Systemtic Name: methyl 3-(3-methoxy-4-methyl-2,6-dinitro-phenyl)-2-oxidanylidene-propanoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C12H12N2O8 MolecularWeight: 312.23228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1OC)[N+](=O)[O-])CC(=O)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1OC)[N+](=O)[O-])CC(=O)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C12H12N2O8/c1-6-4-8(13(17)18)7(5-9(15)12(16)22-3)10(14(19)20)11(6)21-2/h4H,5H2,1-3H3